Chem
J-GLOBAL ID：200907016322659796   Nikkaji number：J2.230.520D

Antimycin A16

アンチマイシンA16
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C30H44N2O9
Molecular formula furigana： C30-H44-N2-O9
Molecular weight： 576.687
InChI： InChI=1S/C30H44N2O9/c1-6-8-9-10-12-22-27(41-24(34)16-15-18(3)7-2)20(5)40-30(38)25(19(4)39-29(22)37)32-28(36)21-13-11-14-23(26(21)35)31-17-33/h11,13-14,17-20,22,25,27,35H,6-10,12,15-16H2,1-5H3,(H,31,33)(H,32,36)/t18?,19-,20+,22-,25+,27+/m1/s1
InChI key： YOGUJNXOXQVUPL-XYHUNJOYSA-N
SMILES： CCCCCC[C@@H]1[C@@H](OC(=O)CCC(C)CC)[C@H](C)OC(=O)[C@@H](NC(=O)c2cccc(NC=O)c2O)[C@@H](C)OC1=O
Systematic name  (3)：
  • 4-メチルヘキサン酸2α,6β-ジメチル-3α-[[2-ヒドロキシ-3-(ホルミルアミノ)-ベンゾイル]アミノ]-4,9-ジオキソ-8β-ヘキシル-1,5-ジオキサシクロノナン-7α-イル
  • (2R,3S,6S,7R,8R)-3-(3-ホルムアミド-2-ヒドロキシベンズアミド)-8-ヘキシル-2,6-ジメチル-4,9-ジオキソ-1,5-ジオキソナン-7-イル 4-メチルヘキサノアート
  • (2R,3S,6S,7R,8R)-3-(3-formamido-2-hydroxybenzamido)-8-hexyl-2,6-dimethyl-4,9-dioxo-1,5-dioxonan-7-yl 4-methylhexanoate
Other name (3)：
  • 4-Methylhexanoic acid 2α,6β-dimethyl-3α-[[2-hydroxy-3-(formylamino)-benzoyl]amino]-4,9-dioxo-8β-hexyl-1,5-dioxacyclononane-7α-yl ester
  • アンチマイシンA16
  • Antimycin A16
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