$165.00
| CAS No.: | 1182-34-9 |
| Molecular Formula | C₂₅H₂₄O₁₂ |
| Molecular Weight | 516.4g/mol |
| Purity | HPLC>98% |
| Chemical Family | Phenylpropanoids |
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IUPAC Name: (3R,5R)-1,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-3,5-dihydroxycyclohexane-1-carboxylic acid
InChI: InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(32)36-23-19(30)11-25(24(34)35,12-20(23)31)37-22(33)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-31H,11-12H2,(H,34,35)/b7-3+,8-4+/t19-,20-,23?,25?/m1/s1
InChIKey: IYXQRCXQQWUFQV-RDJMKVHDSA-N
Canonical SMILES: C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O
Isomeric SMILES: C1[C@H](C([C@@H](CC1(C(=O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)O
Synonyms: 1,4-Dicaffeoylquinic acid; 1182-34-9; 1,4-Dicqa; 1,4-Di-O-caffeoylquinic acid; 1,4-Dicaffeylquinic acid; NSC 91529; 50048OZ68I; (3R,5R)-1,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-3,5-dihydroxycyclohexane-1-carboxylic acid; …
Botanical Source: Lonicera japonica Thunb.
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