| 物质名称 | NEOCHLOROGENIC ACID |
|---|---|
| 异名/同义词 | (1R-(1.ALPHA.,3.ALPHA.,4.ALPHA.,5.BETA.))-3-((3-(3,4-DIHYDROXYPHENYL)-1-OXOALLYL)OXY)-1,4,5-TRIHYDROXYCYCLOHEXANECARBOXYLIC ACID (E)-NEOCHLOROGENIC ACID 3-CQA 3-O-(E)-CAFFEOYLQUINIC ACID CYCLOHEXANECARBOXYLIC ACID, 3-(((2E)-3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)OXY)-1,4,5-TRIHYDROXY-, (1R,3R,4S,5R)- CYCLOHEXANECARBOXYLIC ACID, 3-((3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPENYL)OXY)-1,4,5-TRIHYDROXY-, (1R-(1.ALPHA.,3.ALPHA.(E),4.ALPHA.,5.BETA.))- CYCLOHEXANECARBOXYLIC ACID, 3-((3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPENYL)OXY)-1,4,5-TRIHYDROXY-, (1R-(1.ALPHA.,3.ALPHA.,4.ALPHA.,5.BETA.))- NEOCHLOROGENIC ACID NEOCHLOROGENIC ACID (CONSTITUENT OF ST. JOHN'S WORT) [DSC] |
| CAS登记号 | 906-33-2 |
| 物质唯一标识(Unique Ingredient Identifier) | O4601UER1Z |
| 分子式 | C16H18O9 |
| 国际化合物标识(International Chemical Identifier,InChI) | CWVRJTMFETXNAD-NXLLHMKUSA-N |
| SMILES | O[C@]1(C[C@H]([C@H]([C@@H](C1)O)O)OC(/C=C/c2cc(c(cc2)O)O)=O)C(O)=O |
| 分子结构式 |  |
| 欧洲化学品管理局注册号(ECHA) | 212-997-1 |
| 成分类型 | INGREDIENT SUBSTANCE / chemical |
| 关联数据 | |
| 扩展资源 |