Chem
J-GLOBAL ID:200907091051999431   Nikkaji number:J1.953.765J

(2R)-3α-(α-L-Rhamnopyranosyloxymethyl)-4α-(3,5-dimethoxy-4-hydroxyphenyl)-5,7-dimethoxy-6-hydroxytetralin-2β-methanol

(2R)-3α-(α-L-ラムノピラノシルオキシメチル)-4α-(3,5-ジメトキシ-4-ヒドロキシフェニル)-5,7-ジメトキシ-6-ヒドロキシテトラリン-2β-メタノール
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: C28H38O12
Molecular formula furigana: C28-H38-O12
Molecular weight: 566.600
InChI: InChI=1S/C28H38O12/c1-12-22(30)25(33)26(34)28(40-12)39-11-16-15(10-29)6-13-7-19(37-4)24(32)27(38-5)21(13)20(16)14-8-17(35-2)23(31)18(9-14)36-3/h7-9,12,15-16,20,22,25-26,28-34H,6,10-11H2,1-5H3/t12-,15-,16-,20-,22-,25+,26+,28+/m0/s1
InChI key: MVVPJSSIOPWZBQ-HMXGMDCUSA-N
SMILES: COc1cc(cc(OC)c1O)[C@H]1[C@@H](CO[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@H](CO)Cc2cc(OC)c(O)c(OC)c12
Systematic name  (3):
  • (2R)-3α-(α-L-ラムノピラノシルオキシメチル)-4α-(3,5-ジメトキシ-4-ヒドロキシフェニル)-5,7-ジメトキシ-6-ヒドロキシテトラリン-2β-メタノール
  • (2R,3R,4R,5R,6S)-2-{[(1R,2R,3R)-7-ヒドロキシ-1-(4-ヒドロキシ-3,5-ジメトキシフェニル)-3-(ヒドロキシメチル)-6,8-ジメトキシ-1,2,3,4-テトラヒドロナフタレン-2-イル]メトキシ}-6-メチルオキサン-3,4,5-トリオール
  • (2R,3R,4R,5R,6S)-2-{[(1R,2R,3R)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-6-methyloxane-3,4,5-triol
Other name (1):
  • (2R)-3α-(α-L-Rhamnopyranosyloxymethyl)-4α-(3,5-dimethoxy-4-hydroxyphenyl)-5,7-dimethoxy-6-hydroxytetralin-2β-methanol
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