基本信息 |
|
| 产品名称： | 绿原酸 |
| CAS： | 327-97-9 ;6001-76-9 |
| 中文同义词： | 绿原酸半水化合物 ; 绿原酸 ; 緑原酸 |
| 英文同义词： | 1,3,4,5-TETRAHYDROXYCYCLOHEXANECARBOXYLIC ACID 3-(3,4-DIHYDROXYCINNAMATE) ; 3-O-CAFFEOYLQUINIC ACID ; (1S,3R,4R,5R)-3-[(E)-3-(3,4-DIHYDROXY-PHENYL)-ACRYLOYLOXY]-1,4,5-TRIHYDROXY-CYCLOHEXANECARBOXYLIC ACID ; (E)-CHLOROGENIC ACID ; 3-(3,4-DIHYDROXYCINNAMOYL)QUINIC ACID ; (1S,3R,4R,5R)-3-[[3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPENYL]OXY]-1,4,5-TRIHYDROXYCYCLOHEXANECARBOXYLIC ACID ; HELIANTHIC ACID ; 3-O-(3,4-DIHYDROXYCINNAMOYL)-D-QUINIC ACID ; 3-CAFFEOYLQUINIC ACID ; CHLOROGENIC ACID HEMIHYDRATE ; 5-(3,4-DIHYDROXYCINNAMOYL)-D-(-)-QUINIC ACID ; 3R-[[3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPENYL]OXY]-1S,4R,5R-TRIHYDROXY-CYCLOHEXANECARBOXYLIC ACID ; CAFFETANNIC ACID ; CHLOROGENIC ACID-TRANS ; 3-(3,4-DIHYDROXYCINNAMOYL)-D(-)-QUINIC ACID ; (-)-CHLOROGENIC ACID ; CHLOROGENIC ACID ; ISOCHLOROGENIC ACID ; CAFFEOLYQUINIC ACID |
| MDL号： | MFCD00003862 |
| 氢键受体数量： | 9 |
| 氢键供体数量： | 6 |
| Smile： | c1cc(c(cc1/C=C/C(=O)O[C@@H]2C[C@@](C[C@H]([C@H]2O)O)(C(=O)O)O)O)O |
| InChi： | InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1 |
| InChiKey： | InChIKey=CWVRJTMFETXNAD-JUHZACGLSA-N |
性质 |
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| 熔点： | 210 DEG C (DEC)(LIT)/210℃ |
| 注解： | ASSAY METHOD: TITRATION CAUTION: MAY YIELD A HAZY SOLUTION IN ETHANOL UNSPSC: 12352100 WGK: 3 |
安全信息 |
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| 安全声明： | S:S24/25; |
| WGK德国： | 3 |
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