Chemical Compound

6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-[(1S)-1-{[(1S)-1-({4-[(7S)-13-methoxy-12-(3-{[(7S)-13-methoxy-5-(4-methoxyphenyl)-2-oxo-3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(10),4,8,11,13-pentaen-12-yl]oxy}propoxy)-2-oxo-3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(14),4,8,10,12-pentaen-5-yl]phenyl}carbamoyl)ethyl]carbamoyl}-2-methylpropyl]hexanamide

CAS Registry Number 1342820-51-2
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6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-[(1S)-1-{[(1S)-1-({4-[(7S)-13-methoxy-12-(3-{[(7S)-13-methoxy-5-(4-methoxyphenyl)-2-oxo-3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(10),4,8,11,13-pentaen-12-yl]oxy}propoxy)-2-oxo-3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(14),4,8,10,12-pentaen-5-yl]phenyl}carbamoyl)ethyl]carbamoyl}-2-methylpropyl]hexanamide 结构式
Primary record

6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-[(1S)-1-{[(1S)-1-({4-[(7S)-13-methoxy-12-(3-{[(7S)-13-methoxy-5-(4-methoxyphenyl)-2-oxo-3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(10),4,8,11,13-pentaen-12-yl]oxy}propoxy)-2-oxo-3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(14),4,8,10,12-pentaen-5-yl]phenyl}carbamoyl)ethyl]carbamoyl}-2-methylpropyl]hexanamide

库存
2,020 克
纯度
98.4 %
CAS
1342820-51-2

化合物标识与属性

CAS
1342820-51-2
PubChem CID
89396500
SMILES
C[C@@H](C(=O)NC1=CC=C(C=C1)C2=CN3[C@@H](C2)C=NC4=CC(=C(C=C4C3=O)OC)OCCCOC5=C(C=C6C(=C5)N=C[C@@H]7CC(=CN7C6=O)C8=CC=C(C=C8)OC)OC)NC(=O)[C@H](C(C)C)NC(=O)CCCCCN9C(=O)C=CC9=O
Canonical SMILES
COc1ccc(C2=CN3C(=O)c4cc(OC)c(OCCCOc5cc6c(cc5OC)C(=O)N5C=C(c7ccc(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CCCCCN8C(=O)C=CC8=O)C(C)C)cc7)C[C@H]5C=N6)cc4N=C[C@@H]3C2)cc1

名称与同义词

  • Mc-Val-Ala-pbd
  • Talirine
  • Talirine, maleimide-
  • SGD-1910
  • TALIRINE MALEIMIDE
  • 1342820-51-2
  • RefChem:539134
  • Talirine pyrrole-2,5-dione
  • UNII-1Y234W15BL
  • 1Y234W15BL
  • orb1989100
  • CHEMBL3989965
  • SCHEMBL14659753
  • SCHEMBL29363639
  • BADC-00015
  • SGD-1910 (Mc-Val-Ala-PBD )
  • AKOS032946608
  • EBC-192043
  • BP-43613
  • MS-31950
  • HY-101162
  • CS-0020929
  • G14514
  • A1011555
  • 6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-((S)-1-(((S)-1-((4-((S)-7-methoxy-8-(3-(((S)-7-methoxy-2-(4-methoxyphenyl)-5-oxo-5,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-8-yl)oxy)propoxy)-5-oxo-5,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-2-yl)phenyl)amino)-1-oxopropan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)hexanamide
  • L-Alaninamide, N-(6-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxohexyl)-L-valyl-N-(4-((11aS)-8-(3-(((11aS)-5,11a-dihydro-7-methoxy-2-(4-methoxyphenyl)-5-oxo-1H-pyrrolo(2,1-C)(1,4)benzodiazepin-8-yl)oxy)propoxy)-5,11a-dihydro-7-methoxy-5-oxo-1H-pyrrolo
  • N-[(2S)-1-[[(2S)-1-[4-[(6aS)-3-[3-[[(6aS)-2-methoxy-8-(4-methoxyphenyl)-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]anilino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-6-(2,5-dioxopyrrol-1-yl)hexanamide
  • 6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-((S)-1-(((S)-1-((4-((S)-7-methoxy-8-(3-(((S)-7-methoxy-2-(4-methoxyphenyl)-5-oxo-5,11a-dihydro-1H-benzo(e)pyrrolo(1,2-a)(1,4)diazepin-8-yl)oxy)propoxy)-5-oxo-5,11a-dihydro-1H-benzo(e)pyrrolo(1,2-a)(1,4)diazepin-2-yl)phenyl)amino)-1-oxopropan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)hexanamide
  • 6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-[(1S)-1-{[(1S)-1-({4-[(7S)-13-methoxy-12-(3-{[(7S)-13-methoxy-5-(4-methoxyphenyl)-2-oxo-3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(10),4,8,11,13-pentaen-12-yl]oxy}propoxy)-2-oxo-3,9-diazatricyclo[8.4.0.0^{3,7}]tetradeca-1(14),4,8,10,12-pentaen-5-yl]phenyl}carbamoyl)ethyl]carbamoyl}-2-methylpropyl]hexanamide
  • 6-(2,5-dioxopyrrol-1-yl)-N-[(1S)-1-{[(1S)-1-({4-[(7S)-13-methoxy-12-(3-{[(7S)-13-methoxy-5-(4-methoxyphenyl)-2-oxo-3,9-diazatricyclo[8.4.0.0(3),?]tetradeca-1(10),4,8,11,13-pentaen-12-yl]oxy}propoxy)-2-oxo-3,9-diazatricyclo[8.4.0.0(3),?]tetradeca-1(10),4,8,11,13-pentaen-5-yl]phenyl}carbamoyl)ethyl]carbamoyl}-2-methylpropyl]hexanamide
  • 941-960-9
  • L-ALANINAMIDE, N-(6-(2,5-DIHYDRO-2,5-DIOXO-1H-PYRROL-1-YL)-1-OXOHEXYL)-L-VALYL-N-(4-((11AS)-8-(3-(((11AS)-5,11A-DIHYDRO-7-METHOXY-2-(4-METHOXYPHENYL)-5-OXO-1H-PYRROLO(2,1-C)(1,4)BENZODIAZEPIN-8-YL)OXY)PROPOXY)-5,11A-DIHYDRO-7-METHOXY-5-OXO-1H-PYRROLO(2,1-C)(1,4)BENZODIAZEPIN-2-YL)PHENYL)-
  • N-(6-(3-MERCAPTO-2,5-DIOXO-1-PYRROLIDINYL)-1-OXOHEXYL)-L-VALYL-N-(4-((11AS)-8-(3(((11AS)-5,11A-DIHYDRO-7-METHOXY-2-(4-METHOXYPHENYL)-4-OXO-1H-PYRROLO(2,1-C)(1,4)BENZODIAZEPINE-8-YL)OXY)PROPOXY)-5,11A-DIHYDRO-7-METHOXY-5-OXO-1H-PYRROLO(2,1-C)(1,4)BENZODIAZEPIN-2-YL)PHENYL)-L-ALANINAMIDE