Chem
J-GLOBAL ID:200907049661540370   Nikkaji number:J657.679F

Sagittatoside A

サギッタトシドA
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: C33H40O15
Molecular formula furigana: C33-H40-O15
Molecular weight: 676.668
InChI: InChI=1S/C33H40O15/c1-13(2)5-10-17-18(35)11-19(36)21-24(39)30(28(46-29(17)21)15-6-8-16(43-4)9-7-15)47-33-31(26(41)22(37)14(3)44-33)48-32-27(42)25(40)23(38)20(12-34)45-32/h5-9,11,14,20,22-23,25-27,31-38,40-42H,10,12H2,1-4H3/t14-,20+,22-,23+,25-,26+,27+,31+,32-,33-/m0/s1
InChI key: COHHGQPQHHUMDG-WVQJJEIESA-N
SMILES: COc1ccc(cc1)c1oc2c(CC=C(C)C)c(O)cc(O)c2c(=O)c1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (6):
  • 3-[2-O-(β-D-グルコピラノシル)-α-L-ラムノピラノシルオキシ]-8-(3-メチル-2-ブテニル)-5,7-ジヒドロキシ-4′-メトキシフラボン
  • 5,7-ジヒドロキシ-4′-メトキシ-8-(3-メチル-2-ブテニル)-3-[2-O-(β-D-グルコピラノシル)-α-L-ラムノピラノシルオキシ]フラボン
  • 2-(4-メトキシフェニル)-3-(2-O-β-D-グルコピラノシル-6-デオキシ-α-L-マンノピラノシルオキシ)-5,7-ジヒドロキシ-8-(3-メチル-2-ブテニル)-4H-1-ベンゾピラン-4-オン
  • 5,7-ジヒドロキシ-2-(4-メトキシフェニル)-8-(3-メチル-2-ブテニル)-3-[(2-O-β-D-グルコピラノシル-α-L-ラムノピラノシル)オキシ]-4H-1-ベンゾピラン-4-オン
  • 3-{[(2S,3R,4R,5R,6S)-4,5-ジヒドロキシ-6-メチル-3-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}オキサン-2-イル]オキシ}-5,7-ジヒドロキシ-2-(4-メトキシフェニル)-8-(3-メチルブタ-2-エン-1-イル)-4H-クロメン-4-オン
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Other name (6):
  • 3-[2-O-(β-D-Glucopyranosyl)-α-L-rhamnopyranosyloxy]-8-(3-methyl-2-butenyl)-5,7-dihydroxy-4′-methoxyflavone
  • 5,7-Dihydroxy-4′-methoxy-8-(3-methyl-2-butenyl)-3-[2-O-(β-D-glucopyranosyl)-α-L-rhamnopyranosyloxy]flavone
  • 2-(4-Methoxyphenyl)-3-(2-O-β-D-glucopyranosyl-6-deoxy-α-L-mannopyranosyloxy)-5,7-dihydroxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
  • 5,7-Dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-3-[(2-O-β-D-glucopyranosyl-α-L-rhamnopyranosyl)oxy]-4H-1-benzopyran-4-one
  • サギッタトシドA
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