Primary record
(1R,4R,5R,7R,9R,10S,13R,15S)-15-hydroxy-7-{[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3-[(3-methylbutanoyl)oxy]-4,5-bis(sulfooxy)oxan-2-yl]oxy}-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
- 库存
- 2,580 克
- 纯度
- 99.5 %
- CAS
- 1398-13-6
化合物标识与属性
- CAS
- 1398-13-6
- PubChem CID
- 442005
- SMILES
- CC(C)CC(=O)O[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@@H]2C[C@H]([C@H]3CC[C@@]45C[C@@H](CC[C@H]4[C@@]3(C2)C)C(=C)[C@@H]5O)C(=O)O)CO)OS(=O)(=O)O)OS(=O)(=O)O
- Canonical SMILES
- C=C1[C@@H]2CC[C@H]3[C@]4(C)C[C@H](O[C@@H]5O[C@H](CO)[C@@H](OS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@H]5OC(=O)CC(C)C)C[C@@H](C(=O)O)[C@H]4CC[C@]3(C2)[C@H]1O
名称与同义词
- atractyloside
- Atractylic Acid
- Atractylosidic acid
- AC1L9C38
- NV8NW539H7
- C30H46O16S2
- ZINC8234240
- EINECS 215-743-8
- CID442005
- C30-H46-O16-S2
- J298.603E
- Q640671
- 1398-13-6
- (1R,4R,5R,7R,9R,10S,13R,15S)-15-Hydroxy-7-[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3-(3-methylbutanoyloxy)-4,5-disulfooxyoxan-2-yl]oxy-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
- (1R,4R,5R,7R,9R,10S,13R,15S)-15-hydroxy-7-{[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-3-[(3-methylbutanoyl)oxy]-4,5-bis(sulfooxy)oxan-2-yl]oxy}-9-methyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
- (2beta,4alpha,15alpha)-15-Hydroxy-2-[[2-O-(3-methyl-1-oxobutyl)-3,4-di-O-sulfo-beta-D-glucopyranosyl]oxy]-19-norkaur-16-en-18-oic acid
- 15alpha-Hydroxy-2beta-((2-O-isovaleryl-3,4alpha-di-O-sulpho-beta-D-glucopyranosyl)oxy)-19-norkaur-16-en-18-oic acid
- 15alpha-Hydroxy-2beta-[(2-O-isovaleryl-3-O,4-O-disulfo-beta-D-glucopyranosyl)oxy]-19-norkaur-16-en-18-oic acid
- 15alpha-hydroxy-2beta-[[2-O-isovaleryl-3,4alpha-di-O-sulpho-beta-D-glucopyranosyl]oxy]-19-norkaur-16-en-18-oic acid
- 19-Norkaur-16-en-18-oic acid, 15-hydroxy-2-((2-O-(3-methyl-1-oxobutyl)-3,4-di-O-sulfo-beta-D-glucopyranosyl)oxy)-, (2beta,4alpha,15alpha)-
- 19-Norkaur-16-en-18-oic acid, 15-hydroxy-2-[[2-O-(3-methyl-1-oxobutyl)-3,4-di-O-sulfo-beta-D-glucopyranosyl]oxy]-, (2beta,4alpha,15alpha)-