Chem
J-GLOBAL ID:200907007502381134   Nikkaji number:J759.747I

Huzhangoside B

フズハンゴシドB
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: C64H104O29
Molecular formula furigana: C64-H104-O29
Molecular weight: 1337.507
InChI: InChI=1S/C64H104O29/c1-25-36(68)41(73)45(77)54(85-25)90-49-31(21-65)87-52(47(79)43(49)75)84-24-32-40(72)42(74)46(78)55(88-32)93-58(81)64-18-16-59(3,4)20-28(64)27-10-11-34-61(7)14-13-35(60(5,6)33(61)12-15-63(34,9)62(27,8)17-19-64)89-57-51(39(71)30(67)23-83-57)92-56-48(80)50(37(69)26(2)86-56)91-53-44(76)38(70)29(66)22-82-53/h10,25-26,28-57,65-80H,11-24H2,1-9H3/t25-,26-,28-,29+,30-,31+,32+,33-,34+,35-,36-,37-,38+,39-,40+,41+,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52+,53-,54-,55-,56-,57-,61-,62+,63+,64-/m0/s1
InChI key: GROQHEZXWUJYNW-SBYZPOCPSA-N
SMILES: C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O)[C@@H](O)[C@H]9O)[C@H]8O)C(C)(C)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O
Systematic name  (6):
  • 3β-[[2-O-(3-O-β-D-リボピラノシル-α-L-ラムノピラノシル)-α-L-アラビノピラノシル]オキシ]-28-[[6-O-(4-O-α-L-ラムノピラノシル-β-D-グルコピラノシル)-β-D-グルコピラノシル]オキシ]オレアナ-12-エン-28-オン
  • 3β-[[2-O-(3-O-β-D-リボピラノシル-α-L-ラムノピラノシル)-α-L-アラビノピラノシル]オキシ]オレアナ-12-エン-28-酸6-O-(4-O-α-L-ラムノピラノシル-β-D-グルコピラノシル)-β-D-グルコピラノシル
  • 3β-[2-O-(3-O-β-D-リボピラノシル-α-L-ラムノピラノシル)-α-L-アラビノピラノシルオキシ]オレアナ-12-エン-28-酸6-O-(4-O-α-L-ラムノピラノシル-β-D-グルコピラノシル)-β-D-グルコピラノシル
  • 3β-[2-O-[3-O-(β-D-リボピラノシル)-α-L-ラムノピラノシル]-α-L-アラビノピラノシルオキシ]オレアナ-12-エン-28-酸6-O-[4-O-(α-L-ラムノピラノシル)-β-D-グルコピラノシル]-β-D-グルコピラノシル
  • (2S,3R,4S,5S,6R)-6-({[(2R,3R,4R,5S,6R)-3,4-ジヒドロキシ-6-(ヒドロキシメチル)-5-{[(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]オキシ}メチル)-3,4,5-トリヒドロキシオキサン-2-イル (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-{[(2S,3R,4S,5S)-3-{[(2S,3R,4R,5S,6S)-3,5-ジヒドロキシ-6-メチル-4-{[(2S,3R,4R,5R)-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}オキサン-2-イル]オキシ}-4,5-ジヒドロキシオキサン-2-イル]オキシ}-2,2,6a,6b,9,9,12a-ヘプタメチル-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-イコサヒドロピセン-4a-カルボキシラート
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Other name (6):
  • フズハンゴシドB
  • Huzhangoside B
  • 3β-[[2-O-(3-O-β-D-Ribopyranosyl-α-L-rhamnopyranosyl)-α-L-arabinopyranosyl]oxy]-28-[[6-O-(4-O-α-L-rhamnopyranosyl-β-D-glucopyranosyl)-β-D-glucopyranosyl]oxy]olean-12-en-28-one
  • 3β-[[2-O-(3-O-β-D-Ribopyranosyl-α-L-rhamnopyranosyl)-α-L-arabinopyranosyl]oxy]oleana-12-ene-28-oic acid 6-O-(4-O-α-L-rhamnopyranosyl-β-D-glucopyranosyl)-β-D-glucopyranosyl ester
  • 3β-[2-O-(3-O-β-D-Ribopyranosyl-α-L-rhamnopyranosyl)-α-L-arabinopyranosyloxy]oleana-12-ene-28-oic acid 6-O-(4-O-α-L-rhamnopyranosyl-β-D-glucopyranosyl)-β-D-glucopyranosyl ester
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CAS registry number: 94795-70-7
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