$65.00
| CAS No.: | 905-99-7 |
| Molecular Formula | C₁₆H₁₈O₉ |
| Molecular Weight | 354.31g/mol |
| Purity | HPLC>98% |
| Chemical Family | Phenylpropanoids |
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IUPAC Name: (3R,5R)-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,3,5-trihydroxycyclohexane-1-carboxylic acid
InChI: InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-14-11(19)6-16(24,15(22)23)7-12(14)20/h1-5,11-12,14,17-20,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14?,16?/m1/s1
InChIKey: GYFFKZTYYAFCTR-AVXJPILUSA-N
Canonical SMILES: C1C(C(C(CC1(C(=O)O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O
Isomeric SMILES: C1[C@H](C([C@@H](CC1(C(=O)O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O
Synonyms: Cryptochlorogenic acid; 905-99-7; 4-Caffeoylquinic acid; 4-O-Caffeoylquinic acid; 4-Cqa; 4-o-Caffeoyl quinic acid; Quinic acid 4-O-caffeate; 4-O-(3,4-Dihydroxycinnamoyl)-D-quinic acid; …
Botanical Source: Lonicera japonica Thunb.
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