Chem
J-GLOBAL ID：200907029714079105
Nikkaji number：J5.961G
β-Sitosterol glucoside
β-シトステロールグルコシド
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
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
Molecular formula： C35H60O6
Molecular formula furigana： C35-H60-O6
Molecular weight： 576.859
InChI：
InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-/m1/s1
InChI key：
NPJICTMALKLTFW-OFUAXYCQSA-N
SMILES：
CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(C)C
Systematic name (15)：
- 3β-(β-D-グルコピラノシルオキシ)スチグマスタ-5-エン
- 3β-(β-D-グルコピラノシルオキシ)-スチグマスタ-5-エン-
- [スチグマスタ-5-エン-3β-イル]β-D-グルコピラノシド
- [(24R)-スチグマスタ-5-エン-3β-イル]β-D-グルコピラノシド
- (スチグマスタ-5-エン-3β-イル)β-D-グルコピラノシド
Show all
- シトグルシド
- ダウコステロール
- Daucosterol
- アレキサンドリン
- Alexandrin
Show all
KEGG DRUG：
D05848
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