Chem
J-GLOBAL ID:200907068940709958
Nikkaji number:J691.181A
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-(2-O-α-L-rhamnopyranosyl-6-deoxy-α-L-glucopyranosyl)-4H-1-benzopyran-4-one
2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-6-(2-O-α-L-ラムノピラノシル-6-デオキシ-α-L-グルコピラノシル)-4H-1-ベンゾピラン-4-オン
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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:
C27 H30 O14
Molecular formula furigana:
C27-H30-O14
Molecular weight:
578.523
InChI:
InChI=1S/C27H30O14/c1-8-20(33)23(36)26(41-27-24(37)22(35)19(32)9(2)39-27)25(38-8)18-14(31)7-16-17(21(18)34)13(30)6-15(40-16)10-3-4-11(28)12(29)5-10/h3-9,19-20,22-29,31-37H,1-2H3/t8-,9-,19-,20-,22+,23+,24+,25-,26-,27-/m0/s1
InChI key:
QXHHBGFIPDPRAX-XGYJCEEOSA-N
SMILES:
C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](C)O[C@H]2c2c(O)cc3oc(cc(=O)c3c2O)c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
Systematic name (3):
2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-6-(2-O-α-L-ラムノピラノシル-6-デオキシ-α-L-グルコピラノシル)-4H-1-ベンゾピラン-4-オン
6-[(2S,3S,4R,5R,6S)-4,5-ジヒドロキシ-6-メチル-3-{[(2S,3R,4R,5R,6S)-3,4,5-トリヒドロキシ-6-メチルオキサン-2-イル]オキシ}オキサン-2-イル]-2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-4H-クロメン-4-オン
6-[(2S,3S,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one
Other name (1):
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-(2-O-α-L-rhamnopyranosyl-6-deoxy-α-L-glucopyranosyl)-4H-1-benzopyran-4-one
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