Chem
J-GLOBAL ID:200907082862907368   Nikkaji number:J499.675E

(2R)-2α,5,7-Trihydroxy-3β-methoxy-4α-[(2-O-methyl-6-deoxy-α-L-mannopyranosyl)oxy]-3,4-dihydro-2-methylnaphthacene-1,6,11(2H)-trione

(2R)-2α,5,7-トリヒドロキシ-3β-メトキシ-4α-[(2-O-メチル-6-デオキシ-α-L-マンノピラノシル)オキシ]-3,4-ジヒドロ-2-メチルナフタセン-1,6,11(2H)-トリオン
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: C27H28O12
Molecular formula furigana: C27-H28-O12
Molecular weight: 544.509
InChI: InChI=1S/C27H28O12/c1-9-17(29)21(33)23(36-3)26(38-9)39-22-16-12(24(34)27(2,35)25(22)37-4)8-11-15(20(16)32)19(31)14-10(18(11)30)6-5-7-13(14)28/h5-9,17,21-23,25-26,28-29,32-33,35H,1-4H3/t9-,17-,21+,22+,23+,25-,26-,27-/m0/s1
InChI key: PGCZNTNNZCKKFG-PJBIHHJWSA-N
SMILES: CO[C@@H]1[C@H](O)[C@@H](O)[C@H](C)O[C@H]1O[C@H]1[C@H](OC)[C@@](C)(O)C(=O)c2cc3C(=O)c4cccc(O)c4C(=O)c3c(O)c12
Systematic name  (3):
  • (2R)-2α,5,7-トリヒドロキシ-3β-メトキシ-4α-[(2-O-メチル-6-デオキシ-α-L-マンノピラノシル)オキシ]-3,4-ジヒドロ-2-メチルナフタセン-1,6,11(2H)-トリオン
  • (2R,3S,4R)-4-{[(2S,3R,4R,5R,6S)-4,5-ジヒドロキシ-3-メトキシ-6-メチルオキサン-2-イル]オキシ}-2,5,7-トリヒドロキシ-3-メトキシ-2-メチル-1,2,3,4,6,11-ヘキサヒドロテトラセン-1,6,11-トリオン
  • (2R,3S,4R)-4-{[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy}-2,5,7-trihydroxy-3-methoxy-2-methyl-1,2,3,4,6,11-hexahydrotetracene-1,6,11-trione
Other name (1):
  • (2R)-2α,5,7-Trihydroxy-3β-methoxy-4α-[(2-O-methyl-6-deoxy-α-L-mannopyranosyl)oxy]-3,4-dihydro-2-methylnaphthacene-1,6,11(2H)-trione
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