Chemical Compound

J1.302.027B

J1.302.027B chemical structure
Primary Record

J1.302.027B

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177587116
SMILES
CC1CN(C(=O)NC1=O)C/C=C(\CCNC[C@@H]2[C@H](C[C@@H](O2)N3C=CC(=NC3=O)N)O)/CC(=O)NCC/C(=C\CN4CC(C(=O)NC4=O)C)/CC(=O)NCC/C(=C\CN5CC(C(=O)NC5=O)C)/CC(=O)NCC/C(=C\CN6CC(C(=O)NC6=O)C)/CC(=O)NCC/C(=C\CN7C=NC8=C(N=CN=C87)NCC9=CC=CC=C9)/CC(=O)NCC/C(=C\CN1C=NC2=C(N=CN=C21)NCC1=CC=CC=C1)/CC(=O)NCC/C(=C\CN1CC(C(=O)NC1=O)C)/CC(=O)NCC/C(=C\CN1C=NC2=C(N=CN=C21)NCC1=CC=CC=C1)/CC(=O)NCC/C(=C\CN1CC(C(=O)NC1=O)C)/CC(=O)NCC/C(=C\CN1C=NC2=C(N=CN=C21)NCC1=CC=CC=C1)/CC(=O)NCC(=O)O
Canonical SMILES
CC1CN(C/C=C(\CCNC[C@H]2O[C@@H](n3ccc(N)nc3=O)C[C@@H]2O)CC(=O)NCC/C(=C\CN2CC(C)C(=O)NC2=O)CC(=O)NCC/C(=C\CN2CC(C)C(=O)NC2=O)CC(=O)NCC/C(=C\CN2CC(C)C(=O)NC2=O)CC(=O)NCC/C(=C\Cn2cnc3c(NCc4ccccc4)ncnc32)CC(=O)NCC/C(=C\Cn2cnc3c(NCc4ccccc4)ncnc32)CC(=O)NCC/C(=C\CN2CC(C)C(=O)NC2=O)CC(=O)NCC/C(=C\Cn2cnc3c(NCc4ccccc4)ncnc32)CC(=O)NCC/C(=C\CN2CC(C)C(=O)NC2=O)CC(=O)NCC/C(=C\Cn2cnc3c(NCc4ccccc4)ncnc32)CC(=O)NCC(=O)O)C(=O)NC1=O

Names & Synonyms

  • J1.302.027B
  • 2-[(3E)-3-{2-[(3E)-3-{2-[(3E)-3-{2-[(3E)-3-{2-[(3E)-3-{2-[(3E)-3-{2-[(3E)-3-{2-[(3E)-3-{2-[(3E)-3-{2-[(3E)-3-[2-({[(2R,3S,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl}amino)ethyl]-5-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)pent-3-enamido]ethyl}-5-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)pent-3-enamido]ethyl}-5-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)pent-3-enamido]ethyl}-5-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)pent-3-enamido]ethyl}-5-[6-(benzylamino)-9H-purin-9-yl]pent-3-enamido]ethyl}-5-[6-(benzylamino)-9H-purin-9-yl]pent-3-enamido]ethyl}-5-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)pent-3-enamido]ethyl}-5-[6-(benzylamino)-9H-purin-9-yl]pent-3-enamido]ethyl}-5-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)pent-3-enamido]ethyl}-5-[6-(benzylamino)-9H-purin-9-yl]pent-3-enamido]acetic acid
  • N-(Carboxymethyl)-60-(2 -deoxy-5 -cytidyl)-3,15,27,33-tetrakis[(E)-2-[6-(benzylamino)-9H-purine-9-yl]ethylidene]-9,21,39,45,51,57-hexakis[(E)-2-(2,4-dioxo-5-methylhexahydropyrimidine-1-yl)ethylidene]-7,13,19,25,31,37,43,49,55-nonaoxo-6,12,18,24,30,36,42,48,54,60-decaazahexacontanamide