Chem
J-GLOBAL ID:200907024840168936
Nikkaji number:J33.916D
Auramycinone
アウラマイシノン
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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:
C21 H18 O8
Molecular formula furigana:
C21-H18-O8
Molecular weight:
398.367
InChI:
InChI=1S/C21H18O8/c1-21(28)7-12(23)14-9(16(21)20(27)29-2)6-10-15(19(14)26)18(25)13-8(17(10)24)4-3-5-11(13)22/h3-6,12,16,22-23,26,28H,7H2,1-2H3/t12-,16-,21+/m0/s1
InChI key:
WCKNDRCJQZCZLO-LBJGKRIESA-N
SMILES:
COC(=O)[C@@H]1c2cc3C(=O)c4cccc(O)c4C(=O)c3c(O)c2[C@@H](O)C[C@@]1(C)O
Systematic name (4):
(1R)-1,2,3,4,6,11-ヘキサヒドロ-2α,4α,5,7-テトラヒドロキシ-2-メチル-6,11-ジオキソ-1-ナフタセンカルボン酸メチル
(1R,2R,4S)-2-メチル-1,2,3,4,6,11-ヘキサヒドロ-2,4,5,7-テトラヒドロキシ-6,11-ジオキソ-1-ナフタセンカルボン酸メチル
メチル (1R,2R,4S)-2,4,5,7-テトラヒドロキシ-2-メチル-6,11-ジオキソ-1,2,3,4,6,11-ヘキサヒドロテトラセン-1-カルボキシラート
methyl (1R,2R,4S)-2,4,5,7-tetrahydroxy-2-methyl-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene-1-carboxylate
Other name (5):
オーラマイシノン
Auramycinone
(1R)-1,2,3,4,6,11-Hexahydro-2α,4α,5,7-tetrahydroxy-2-methyl-6,11-dioxo-1-naphthacenecarboxylic acid methyl ester
アウラマイシノン
(1R,2R,4S)-2-Methyl-1,2,3,4,6,11-hexahydro-2,4,5,7-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid methyl ester
CAS registry number:
78173-89-4
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