Chem
J-GLOBAL ID:200907022079382519   Nikkaji number:J838.076G

Angoroside C

アンゴロシドC
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: C36H48O19
Molecular formula furigana: C36-H48-O19
Molecular weight: 784.761
InChI: InChI=1S/C36H48O19/c1-16-26(41)28(43)30(45)36(52-16)55-33-31(46)35(49-11-10-18-5-8-22(47-2)20(38)12-18)53-24(15-51-34-29(44)27(42)21(39)14-50-34)32(33)54-25(40)9-6-17-4-7-19(37)23(13-17)48-3/h4-9,12-13,16,21,24,26-39,41-46H,10-11,14-15H2,1-3H3/b9-6+/t16-,21-,24+,26-,27-,28+,29+,30+,31+,32+,33+,34-,35+,36-/m0/s1
InChI key: KLQXMRBGMLHBBQ-DQTDZZOCSA-N
SMILES: COc1ccc(CCO[C@@H]2O[C@H](CO[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@@H](OC(=O)/C=C/c3ccc(O)c(OC)c3)[C@H](O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@H]2O)cc1O
Systematic name  (4):
  • 3-ヒドロキシ-4-メトキシフェネチル3-O-α-L-ラムノピラノシル-4-O-(3-メトキシ-4-ヒドロキシシンナモイル)-6-O-α-L-アラビノピラノシル-β-D-グルコピラノシド
  • 2-(3-ヒドロキシ-4-メトキシフェニル)エチル3-O-α-L-ラムノピラノシル-4-O-[(E)-3-(4-ヒドロキシ-3-メトキシフェニル)プロペノイル]-6-O-α-L-アラビノピラノシル-β-D-グルコピラノシド
  • (2R,3R,4R,5R,6R)-5-ヒドロキシ-6-[2-(3-ヒドロキシ-4-メトキシフェニル)エトキシ]-4-{[(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}-2-({[(2S,3R,4S,5S)-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}メチル)オキサン-3-イル (2E)-3-(4-ヒドロキシ-3-メトキシフェニル)プロパ-2-エノアート
  • (2R,3R,4R,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-4-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2-({[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-3-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Other name (4):
  • 3-Hydroxy-4-methoxyphenethyl 3-O-α-L-rhamnopyranosyl-4-O-(3-methoxy-4-hydroxycinnamoyl)-6-O-α-L-arabinopyranosyl-β-D-glucopyranoside
  • 2-(3-Hydroxy-4-methoxyphenyl)ethyl 3-O-α-L-rhamnopyranosyl-4-O-[(E)-3-(4-hydroxy-3-methoxyphenyl)propenoyl]-6-O-α-L-arabinopyranosyl-β-D-glucopyranoside
  • アンゴロシドC
  • Angoroside C
CAS registry number: 115909-22-3
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