TerraTox - HIV-1 structure file, May 2004. Copyright ... - TerraBase Inc.

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3375 C22H24N2OS 2-(alkylthio)-pyrimidin-4-ol deriv.; T-4130-107 C4CCCCCC4Sc1nc(O)cc(n1)Cc2cccc3ccccc23 3376 C22H24N4O bis(heteroaryl)piperazine deriv.; T-4422-045 CCNc1cccnc1N2CCN(CC2)C(=O)c3cc4ccccc4cc3 3377 C22H24N6O 1-[(6-cyano-1H-indol-2-yl)carbonyl]-4-[([1- methylethyl]amino)pyridin-2-yl]piperazine; T-4384-013 c1c(C#N)ccc2cc(nc12)C(=O)N3CCN(CC3)c4c(NC(C)C)cccn4 3378 C22H24O5 calanolide deriv; T-4847-006 O=C1[C@@H](C)[C@@H](C)Oc2c3C=CC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 3379 C22H24O5 calanolide deriv.; T-4637-004 O=C1[C@H](C)[C@@H](C)Oc2c3C=CC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 3380 C22H24O5 12-oxocalanolide A (+) O1[C@H](C)[C@@H](C)C(=O)c2c3OC(=O)C=C(CCC)c3c4OC(C)(C)C=Cc4c12 3381 C22H24O5 12-oxocalanolide A (+/-) O1[C@H](C)[C@@H](C)C(=O)c2c3OC(=O)C=C(CCC)c3c4OC(C)(C)C=Cc4c12 3382 C22H24O5 12-oxocalanolide A (-) O1[C@H](C)[C@@H](C)C(=O)c2c3OC(=O)C=C(CCC)c3c4OC(C)(C)C=Cc4c12 3383 C22H25FN4O bis(heteroaryl)piperazine deriv.; T-4422-054 c1cccc2cc(nc12)C(=O)N3CCN(CC3)c4cc(F)ccc4NC(C)C 3384 C22H25FN4O bis(heteroaryl)piperazine deriv.; T-4422-053 c1cccc2cc(nc12)C(=O)N3CCN(CC3)c4ccc(F)cc4NC(C)C 3385 C22H25F3N6O3S 1-[(5-trifluoromethylsulfonamido-1H-indol-2-yl)carbonyl]- 4-[([1-methylethyl]amino)pyridin-2-yl]piperazine; T- 4384-020 c1cc(NS(=O)(=O)C(F)(F)F)cc2cc(nc12)C(=O)N3CCN(CC3)c4c(NC(C)C)cccn4 3386 C22H25NO3S O-(2-phenoxyethyl) thiocarbamate deriv.; T-4418-163 c1ccccc1OCCOC(=S)N(C2CCCCC2)C(=O)c3ccccc3 3387 C22H25N3S TIBO deriv.; T-4175-015 c1ccc2N=C(Sc4ccccc4)N3CC(C)N(C/C=C(C)/C)Cc1c23 3388 C22H25N5O bis(heteroaryl)piperazine deriv.; T-4422-076 C5CC5CNc1cccnc1N2CCN(CC2)C(=O)c3nc4ccccc4c3 3389 C22H25N5O2 1-[(6-carbonylo-1H-indol-2-yl)carbonyl]-4-[([1- methylethyl]amino)pyridin-2-yl]piperazine; T-4384-014 c1c(C=O)ccc2cc(nc12)C(=O)N3CCN(CC3)c4c(NC(C)C)cccn4 3390 C22H25N6O4P 3-methyl-cyclo-saligenyl-Abacavir-monophosphate Cc1cccc2COP(Oc12)(=O)OC[C@@H]5C=C[C@@H](C5)n3cnc4c(NC6CC6)nc(N)nc34 3391 C22H25N6O5P 5-methoxy-cyclo-saligenyl-Abacavir-monophosphate c1cc(OC)cc2COP(Oc12)(=O)OC[C@@H]5C=C[C@@H](C5)n3cnc4c(NC6CC6)nc(N)nc34 3392 C22H26Br2O6 (-)-gomisin J dibromo deriv.; 4159-003 OCc1c(OC)c(O)c(Br)c2(c14)C[C@H](C)[C@H](C)Cc3c(Br)c(O)c(OC)c(OC)c34 3393 C22H26Cl2O6 (-)-gomisin J dichloro deriv.; 4159-002 OCc1c(OC)c(O)c(Cl)c2(c14)C[C@H](C)[C@H](C)Cc3c(Cl)c(O)c(OC)c(OC)c34 3394 C22H26FN5O bis(heteroaryl)piperazine deriv.; T-4422-083 CC(C)(C)Nc1cccnc1N2CCN(CC2)C(=O)c3nc4ccc(F)cc4c3 3395 C22H26I2O6 (-)-gomisin J diiodo deriv.; 4159-004 OCc1c(OC)c(O)c(I)c2(c14)C[C@H](C)[C@H](C)Cc3c(I)c(O)c(OC)c(OC)c34 3396 C22H26N4O bis(heteroaryl)piperazine deriv.; T-4422-051 c1cccc2cc(nc12)C(=O)N3CCN(CC3)c4ccccc4NC(C)C 6,6-dimethyl-9-ethoxy-10-propionyl-4-propyl-2H,6Hbenzo[1,2-b:3,4-b']dipyran-2-one (+/-) CCC(=O)c1c(OCC)c2C=CC(C)(C)Oc2c3C(CCC)=CC(=O)Oc13 3397 C22H26O5 3398 C22H26O5 epi-calanolide C (+/-) O[C@@H]1[C@@H](C)[C@@H](C)Oc2c3C=CC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 3399 C22H26O5 calanolide deriv; T-4847-008 O[C@@H]1[C@H](C)[C@@H](C)Oc2c3C=CC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 3400 C22H26O5 calanolide C (+/-) O[C@H]1[C@@H](C)[C@@H](C)Oc2c3C=CC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 3401 C22H26O5 (-)-calanolide B; NSC 661122 O[C@H]1[C@@H](C)[C@H](C)Oc2c3C=CC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 142632-33-5
3402 C22H26O5 (+)-cathonolide A O[C@H]1[C@H](C)[C@@H](C)Oc2c3C=CC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 3403 C22H26O5 calanolide deriv; T-4847-007 O[C@H]1[C@H](C)[C@@H](C)Oc2c3C=CC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 3404 C22H26O5 calanolide deriv.; T-4637-005 O=C1[C@@H](C)[C@@H](C)OC2C3C=CC(C)(C)OC3=C4C(CCC)=CC(=O)OC4=C12 3405 C22H26O5 calanolide deriv.; T-4637-007 O=C1[C@H](C)[C@@H](C)Oc2c3CCC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 3406 C22H26O5 costatolide O1[C@@H](C)[C@H](C)[C@H](O)c2c3OC(=O)C=C(CCC)c3c4OC(C)(C)C=Cc4c12 3407 C22H26O5 (+)-calanolide A O1[C@H](C)[C@@H](C)[C@H](O)c2c3OC(=O)C=C(CCC)c3c4OC(C)(C)C=Cc4c12 142632-32-4 3408 C22H26O5 10,11-dihydro-12-hydroxy-4-propyl-6,6,10,10- tetramethyl-2H,6H,12H-benzo[1,2-b:3,4-b':5,6- b'']tripyran-2-one (+/-) OC1CC(C)(C)Oc2c3C=CC(C)(C)Oc3c4C(CCC)=CC(=O)Oc4c12 3409 C22H26O6 calanolide deriv; T-4847-003 C[C@H](O)[C@@H](C)C(=O)c1c(O)c2C=CC(C)(C)Oc2c3C(CCC)=CC(=O)Oc13 3410 C22H26O6 calanolide deriv; T-4847-004 C[C@H](O)[C@H](C)C(=O)c1c(O)c2C=CC(C)(C)Oc2c3C(CCC)=CC(=O)Oc13 c1cc(Br)ccc1OP(NC(C)C(=O)C(=O)OC)(=O)OC[C@@H]2[C@@H](N=N#N)C[C@@H](O2) N3C(=O)NC(=O)[C@@](C)(Br)[C@H]3OC 3411 C22H27Br2N6O10P Zidovudine deriv.; T-4192-001 3412 C22H27NO4 (-)-aza-calanolide A O1[C@@H](C)[C@H](C)[C@@H](O)c2c3nc(O)cc(CCC)c3c4OC(C)(C)C=Cc4c12 3413 C22H27NO4 (+)-aza-calanolide A O1[C@H](C)[C@@H](C)[C@H](O)c2c3nc(O)cc(CCC)c3c4OC(C)(C)C=Cc4c12 3414 C22H27NO4 (+/-)-aza-calanolide A O1C(C)C(C)C(O)c2c3nc(O)cc(CCC)c3c4OC(C)(C)C=Cc4c12 3415 C22H27NO7 threo-2,3-di(3,4-dihydroxybenzyl)succinic acid mono- N,N-diethylamide c1cc(O)c(O)cc1C[C@H](C(=O)O)[C@@H](C(=O)N(CC)CC)Cc2cc(O)c(O)cc2 3416 C22H27N5O bis(heteroaryl)piperazine deriv.; T-4422-077 C(C)(C)(C)Nc1cccnc1N2CCN(CC2)C(=O)c3nc4ccccc4c3 3417 C22H27N5O 1-[(5-methyl-1H-indol-2-yl)carbonyl]-4-[([1- methylethyl]amino)pyridin-2-yl]piperazine; T-4384-007 c1cc(C)cc2cc(nc12)C(=O)N3CCN(CC3)c4c(NC(C)C)cccn4 3418 C22H27N5O bis(heteroaryl)piperazine deriv.; T-4422-065 CCC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3nc4ccccc4c3 3419 C22H27N5O bis(heteroaryl)piperazine deriv.; T-4422-060 CCN(CC)c1cccnc1N2CCN(CC2)C(=O)c3nc4ccccc4c3 3420 C22H27N5O2 1-[(6-hydroxymethyl-1H-indol-2-yl)carbonyl]-4-[([1- methylethyl]amino)pyridin-2-yl]piperazine; T-4384-023 c1c(CO)ccc2cc(nc12)C(=O)N3CCN(CC3)c4c(NC(C)C)cccn4 1-[(6-methoxy-1H-indol-2-yl)carbonyl]-4-[([1- 3421 C22H27N5O2 methylethyl]amino)pyridin-2-yl]piperazine; T-4384-009 c1c(OC)ccc2cc(nc12)C(=O)N3CCN(CC3)c4c(NC(C)C)cccn4 3422 C22H27N5O2 bis(heteroaryl)piperazine deriv.; T-4422-082 CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3nc4ccc(OC)cc4c3 3423 C22H27N5O4S 1-[(6-methylsulfonyloxy-1H-indol-2-yl)carbonyl]-4-[([1- methylethyl]amino)pyridin-2-yl]piperazine; T-4384-022 c1c(OS(=O)(=O)C)ccc2cc(nc12)C(=O)N3CCN(CC3)c4c(NC(C)C)cccn4 3424 C22H27N5O4S 1-[(5-methylsulfonyloxy-1H-indol-2-yl)carbonyl]-4-[([1- methylethyl]amino)pyridin-2-yl]piperazine; T-4384-015 c1cc(OS(=O)(=O)C)cc2cc(nc12)C(=O)N3CCN(CC3)c4c(NC(C)C)cccn4
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TerraTox - HIV-1 structure file, Ma
Page 3 and 4:
46 C8H9BrN2O5 47 C8H9BrN2O5 alpha-(
Page 5 and 6:
109 C8H11N3O3S (-)-2'-deoxy-3'-oxa-
Page 7 and 8:
156 C9H9F2N3O3 157 C9H9F2N3O3 158 C
Page 9 and 10:
213 C9H10O4 214 C9H10O5 ethyl 3,4-d
Page 11 and 12:
274 C9H13FN5O4P (2R/S)-6-amino-9-[2
Page 13 and 14:
325 C10H9F2N5O2 9-(2',3'-dideoxy-2'
Page 15 and 16:
376 C10H12FN5O2 2',3'-dideoxyadenos
Page 17 and 18:
433 C10H14FN3O3 1-(2-fluoro-2,3-did
Page 19 and 20:
484 C11H8ClNO2S2 thiazolothiazepine
Page 21 and 22:
545 C11H14N2O4 HEPT analogue; T-398
Page 23 and 24:
597 C12H8ClN5O2 5CITEP; 3-hydroxypr
Page 25 and 26:
645 C12H11ClFN3OS phenethylthiazoly
Page 27 and 28:
698 C12H14N2O3 pyridin-2-ol deriv.;
Page 29 and 30:
749 C13H9BrN2OS 2-amino-6-arylsulfo
Page 31 and 32:
794 C13H11ClN2O3S2 795 C13H11ClN2O3
Page 33 and 34:
843 C13H13ClN2O4S N-(3-chloro-6-ami
Page 35 and 36:
898 C13H15N3OS2 N-(thiazol-2-yl)hio
Page 37 and 38:
951 C14H7F6NO2 Efavirenz analogue;
Page 39 and 40:
1003 C14H9N3S 2-amino-6-arylsulfony
Page 41 and 42:
1052 C14H11F4NO2 Efavirenz analogue
Page 43 and 44:
1096 C14H12N2O3S 2-amino-6-arylsulf
Page 45 and 46:
1142 C14H13N3O 5,11-dihydro-6H-pyri
Page 47 and 48:
1190 C14H15ClN2O2S 1191 C14H15ClN2O
Page 49 and 50:
1243 C14H16N2O3S HEPT derivative; T
Page 51 and 52:
1297 C14H17N3OS 2-(sec-butoxy)-4-am
Page 53 and 54:
1350 C15H8Cl2O3 3-hydroxyflavone, 3
Page 55 and 56:
1406 C15H11F3N2O2S 2-amino-6-arylsu
Page 57 and 58:
1459 C15H12O4 1,3-di(4-hydroxy-3-me
Page 59 and 60:
1510 C15H14FN3O 1511 C15H14FN3O 151
Page 61 and 62:
1558 C15H15N3O 5,11-dihydro-6H-pyri
Page 63 and 64:
1614 C15H16N4O dipyridodiazepinone
Page 65 and 66:
1673 C15H18N2O2S 2-(4-methylphenylt
Page 67 and 68:
1733 C15H19N3O2 pyrid-2-ol deriv.;
Page 69 and 70:
1786 C16H6O8S 3,4-dicarboxylic acid
Page 71 and 72:
1827 C16H13ClF3N3O 6,11-dihydro-5H-
Page 73 and 74:
1884 C16H15F3N2O3 Efavirenz analogu
Page 75 and 76: 1939 C16H16N2O4S NSC 667948 c1c([H]
Page 77 and 78: 1991 C16H18Cl2N2OS pyrimidin-4-ol d
Page 79 and 80: 2054 C16H19N3O3S pyrimidin-4-ol der
Page 81 and 82: 2117 C16H20N2O4 2118 C16H20N2O4S OC
Page 83 and 84: 2180 C16H24N6O5 2181 C16H26N2O5Si 2
Page 85 and 86: 2231 C17H15ClN2O4S indolyl aryl sul
Page 87 and 88: 2294 C17H17N2O7P 7-methyl-cyclo-sal
Page 89 and 90: 2350 C17H19ClF2N4S phenethylthiazol
Page 91 and 92: 2405 C17H20N2O3 N-benzyl-6,7-dihydr
Page 93 and 94: 2472 C17H23N3O TIBO deriv.; T-4175-
Page 95 and 96: 2529 C18H14N2O3S2 1H-thieno[2,3-c][
Page 97 and 98: 2587 C18H18N2O2 pyridin-2-ol deriv.
Page 99 and 100: threo-2,3-di(3,4-dihydroxybenzyl)su
Page 101 and 102: 2702 C18H24ClN3S R86162 c1c(Cl)cc2N
Page 103 and 104: 2756 C18H31N3O8SSi 2757 C18H31N3O8S
Page 105 and 106: 2803 C19H18BrN5OS N-[2-(6,7-dihydro
Page 107 and 108: 2855 C19H20N5O5P 3-methyl-cyclo-sal
Page 109 and 110: 2908 C19H24O9 chromene glucuside Cc
Page 111 and 112: 2966 C20H17N2O7P benzo[c]-cyclo-sal
Page 113 and 114: 3026 C20H21N3O TIBO deriv.; T-4169-
Page 115 and 116: 3075 C20H24N4O2 6,11-dihydro-5H-pyr
Page 117 and 118: 3126 C21H14F4N2 1,2-diphenylbenzimi
Page 119 and 120: 3190 C21H20Br2O6 alkenyldiarylmetha
Page 121 and 122: 3248 C21H23N3O2 bis(heteroaryl)pipe
Page 123 and 124: 3291 C21H29ClN4O2 bis(heteroaryl)pi
Page 125: 3343 C22H20ClN5O2 diazepinone deriv
Page 129 and 130: 3446 C22H31NO5 3449 C22H33NO4 estra
Page 131 and 132: 3499 C23H22N2O6S2 1H-thieno[2,3-c][
Page 133 and 134: 3538 C23H28O5 10,11-cis-10,11-dihyd
Page 135 and 136: 3585 C24H24O12 1,4,8-trihydroxynaph
Page 137 and 138: 3630 C24H42IN3O8SSi2 TSAO deriv.; T
Page 139 and 140: 3674 C25H24O12 (-)-3,5-dicaffeoyl-m
Page 141 and 142: 3721 C25H34N10NaO9PS B1 C1[C@H](n3c
Page 143 and 144: 3767 C26H26O12 methyl 3,5-dicaffeoy
Page 145 and 146: 3812 C26H34O5S 4-hydroxy-5,6-dihydr
Page 147 and 148: 3859 C27H25N3O2 cyclic urea deriv.;
Page 149 and 150: 3900 C27H34BrN3O3 1'-(2-hydroxy-6-m
Page 151 and 152: 3939 C27H36N2O5S2 4-hydroxy-5,6-dih
Page 153 and 154: 3981 C28H31N5O2 1-[(6-benzyloxy-1H-
Page 155 and 156: 4017 C28H36ClN3O6 2-methyl-3-hydrox
Page 157 and 158: 4057 C28H40N8O3S piperidine deriv.;
Page 159 and 160: 4097 C29H37F3N4O4 4098 C29H37NO8 4-
Page 161 and 162: 4136 C29H50N4O11SSi2 4137 C29H51N5O
Page 163 and 164: 4175 C30H41N3O2 5-oxopyrrolidine-3-
Page 165 and 166: 4214 C31H20O6 3,3'-(4-phenylbezylid
Page 167 and 168: 4255 C31H39N5O7 4256 C31H39N5O8 1-[
Page 169 and 170: N-3-benzoyloxymethyl / N-3-carboxym
Page 171 and 172: 4332 C32H37IN2O TAK-779 derivative;
Page 173 and 174: 4374 C32H44O8 cucurbitacin E CC1(C)
Page 175 and 176: 4411 C33H22O8 3,3'-(4-stilbenomethy
Page 177 and 178:
4452 C33H37Cl2N3O2 5-oxopyrrolidine
Page 179 and 180:
4491 C33H40N2O7 N-(2(R)-hydroxy-1(S
Page 181 and 182:
4528 C33H53NO4 betulinic acid deriv
Page 183 and 184:
4569 C34H40ClN3O5 2-methyl-3-hydrox
Page 185 and 186:
4609 C34H51N5O8 hydroxyethylhydrazi
Page 187 and 188:
4647 C35H38N2O3 cyclic urea deriv.;
Page 189 and 190:
4685 C35H46O9 phorbol deriv.; T-422
Page 191 and 192:
4723 C36H38N2O6S cyclic sulfondiami
Page 193 and 194:
4761 C36H55NO6 triterpene acid / he
Page 195 and 196:
Page 197 and 198:
4837 C37H58O6 3-(3,3-dimethyl-1,5-p
Page 199 and 200:
4873 C38H47N5O7S tripeptide deriv.;
Page 201 and 202:
4909 C38H63NO4 betulinic acid deriv
Page 203 and 204:
4942 C39H53N7O7 hydroxyethylhydrazi
Page 205 and 206:
4977 C40H53N5O8 meta-/paracyclophan
Page 207 and 208:
Page 209 and 210:
5043 C42H52N6O8 L-mannaric acid dia
Page 211 and 212:
5075 C43H61N5O8 HIV protease inhibi
Page 213 and 214:
Page 215 and 216:
5138 C47H46N6O5 SB-570 5139 C47H46N
Page 217 and 218:
5168 C48H82N2O5 betulinic acid deri
Page 219 and 220:
5196 C55H81N5O14 Indinavir-PEG350(8
show all

TerraTox - HIV-1 structure file, May 2004. Copyright ... - TerraBase Inc.

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