Glycine, N-((5-((6-deoxy-3-O-beta-D-xylopyranosyl-beta-D-galactopyranosyl)oxy)-11-(dimethylamino)-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxobenzo(a)naphthacen-2-yl)carbonyl)-, (5S-trans)-

HCID 461701

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基本情報

CAS: 153619-41-1
標準SMILES: Cc1cc2c(c(O)c1C(=O)NCC(=O)O)-c1c(cc3c(c1O)C(=O)c1cc(N(C)C)cc(O)c1C3=O)[C@H](O)[C@H]2O[C@@H]1O[C@H](C)[C@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O
InChIKey: CIMMDJKHFTZVAC-PCAYTWTGSA-N
分子式: C39H42N2O18
平均分子量: 826.761 g/mol
単同位体質量: 826.2432625

優先名称: Glycine, N-((5-((6-deoxy-3-O-beta-D-xylopyranosyl-beta-D-galactopyranosyl)oxy)-11-(dimethylamino)-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxobenzo(a)naphthacen-2-yl)carbonyl)-, (5S-trans)-
IUPAC: {[(5S,6S)-5-{[(2S,3R,4S,5S,6R)-3,5-Dihydroxy-6-methyl-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-11-(dimethylamino)-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carbonyl]amino}acetic acid

読み込み中…

CAS: 153619-41-1
標準SMILES: Cc1cc2c(c(O)c1C(=O)NCC(=O)O)-c1c(cc3c(c1O)C(=O)c1cc(N(C)C)cc(O)c1C3=O)[C@H](O)[C@H]2O[C@@H]1O[C@H](C)[C@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O
InChIKey: CIMMDJKHFTZVAC-PCAYTWTGSA-N
分子式: C39H42N2O18
平均分子量: 826.761 g/mol
単同位体質量: 826.2432625

優先名称: Glycine, N-((5-((6-deoxy-3-O-beta-D-xylopyranosyl-beta-D-galactopyranosyl)oxy)-11-(dimethylamino)-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxobenzo(a)naphthacen-2-yl)carbonyl)-, (5S-trans)-
IUPAC: {[(5S,6S)-5-{[(2S,3R,4S,5S,6R)-3,5-Dihydroxy-6-methyl-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-11-(dimethylamino)-1,6,9,14-tetrahydroxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carbonyl]amino}acetic acid

読み込み中…