Chem
J-GLOBAL ID：200907030749665153   Nikkaji number：J687.844J

3β-[2-O-(α-L-Rhamnopyranosyl)-3-O-(α-L-arabinofuranosyl)-β-L-arabinopyranosyloxy]-23-hydroxyolean-12-en-28-oic acid

3β-[2-O-(α-L-ラムノピラノシル)-3-O-(α-L-アラビノフラノシル)-β-L-アラビノピラノシルオキシ]-23-ヒドロキシオレアナ-12-エン-28-酸
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： C46H74O16
Molecular formula furigana： C46-H74-O16
Molecular weight： 883.082
InChI： InChI=1S/C46H74O16/c1-22-30(50)32(52)34(54)37(58-22)62-36-35(61-38-33(53)31(51)26(19-47)59-38)25(49)20-57-39(36)60-29-11-12-42(4)27(43(29,5)21-48)10-13-45(7)28(42)9-8-23-24-18-41(2,3)14-16-46(24,40(55)56)17-15-44(23,45)6/h8,22,24-39,47-54H,9-21H2,1-7H3,(H,55,56)/t22-,24-,25-,26-,27+,28+,29-,30-,31-,32+,33+,34+,35-,36+,37-,38-,39+,42-,43-,44+,45+,46-/m0/s1
InChI key： QVBKGGLCKCDNHS-QAGBWMQISA-N
SMILES： C[C@@H]1O[C@@H](O[C@H]2[C@@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@@]6(CC[C@@]54C)C(=O)O)[C@]3(C)CO)OC[C@H](O)[C@@H]2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O
Systematic name  (4)：
  • 3β-[2-O-(α-L-ラムノピラノシル)-3-O-(α-L-アラビノフラノシル)-β-L-アラビノピラノシルオキシ]-23-ヒドロキシオレアナ-12-エン-28-酸
  • 3β-[[2-O-(α-L-ラムノピラノシル)-3-O-(α-L-アラビノフラノシル)-β-L-アラビノピラノシル]オキシ]-23-ヒドロキシオレアナ-12-エン-28-酸
  • (4aS,6aS,6bR,8aR,9R,10S,12aR,12bR,14bS)-10-{[(2R,3R,4S,5S)-4-{[(2S,3R,4R,5S)-3,4-ジヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]オキシ}-5-ヒドロキシ-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]オキシ}-9-(ヒドロキシメチル)-2,2,6a,6b,9,12a-ヘキサメチル-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-カルボン酸
  • (4aS,6aS,6bR,8aR,9R,10S,12aR,12bR,14bS)-10-{[(2R,3R,4S,5S)-4-{[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-5-hydroxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid
Other name (2)：
  • 3β-[2-O-(α-L-Rhamnopyranosyl)-3-O-(α-L-arabinofuranosyl)-β-L-arabinopyranosyloxy]-23-hydroxyolean-12-en-28-oic acid
  • 3β-[[2-O-(α-L-Rhamnopyranosyl)-3-O-(α-L-arabinofuranosyl)-β-L-arabinopyranosyl]oxy]-23-hydroxyoleana-12-ene-28-oic acid
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