1R-ChI

HCID 24978540

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기본 정보

표준 SMILES: CN(C)CCCNC(=O)CCNC(=O)c1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4cc(NC(=O)[C@@H](CCNC(=O)CCCc5ccc(N(CCCl)CCCl)cc5)NC(=O)c5nc(NC(=O)CCNC(=O)c6nc(NC(=O)c7nccn7C)cn6C)cn5C)cn4C)cn3C)cn2C)cn1C
InChIKey: ONMLDEZSEUDARW-QSCHNALKSA-N
분자식: C68H87Cl2N23O11
평균 분자량: 1,473.5 g/mol
단동위원소 질량: 1,471.63324596

우선 이름: 1R-ChI
IUPAC: N-{3-[(2-{[(2R)-4-(4-{4-[Bis(2-chloroethyl)amino]phenyl}butanamido)-1-({5-[(5-{[5-({5-[(3-{[3-(dimethylamino)propyl]amino}-3-oxopropyl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}amino)-1-oxobutan-2-yl]carbamoyl}-1-methyl-1H-imidazol-4-yl)amino]-3-oxopropyl}-1-methyl-4-[(1-methyl-1H-imidazole-2-carbonyl)amino]-1H-imidazole-2-carboxamide

불러오는 중…

표준 SMILES: CN(C)CCCNC(=O)CCNC(=O)c1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4cc(NC(=O)[C@@H](CCNC(=O)CCCc5ccc(N(CCCl)CCCl)cc5)NC(=O)c5nc(NC(=O)CCNC(=O)c6nc(NC(=O)c7nccn7C)cn6C)cn5C)cn4C)cn3C)cn2C)cn1C
InChIKey: ONMLDEZSEUDARW-QSCHNALKSA-N
분자식: C68H87Cl2N23O11
평균 분자량: 1,473.5 g/mol
단동위원소 질량: 1,471.63324596

우선 이름: 1R-ChI
IUPAC: N-{3-[(2-{[(2R)-4-(4-{4-[Bis(2-chloroethyl)amino]phenyl}butanamido)-1-({5-[(5-{[5-({5-[(3-{[3-(dimethylamino)propyl]amino}-3-oxopropyl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}amino)-1-oxobutan-2-yl]carbamoyl}-1-methyl-1H-imidazol-4-yl)amino]-3-oxopropyl}-1-methyl-4-[(1-methyl-1H-imidazole-2-carbonyl)amino]-1H-imidazole-2-carboxamide

불러오는 중…