$50.00
| CAS No.: | 57378-72-0 |
| Molecular Formula | C₂₅H₂₄O₁₂ |
| Molecular Weight | 516.4g/mol |
| Purity | HPLC>98% |
| Chemical Family | Phenylpropanoids |
| Weight |
|---|
IUPAC Name: (1R,3R,4S,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid
InChI: InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)/b7-3+,8-4+/t19-,20-,23+,25-/m1/s1
InChIKey: UFCLZKMFXSILNL-RVXRWRFUSA-N
Canonical SMILES: C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O
Isomeric SMILES: C1[C@H]([C@@H]([C@@H](C[C@]1(C(=O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)OC(=O)/C=C/C3=CC(=C(C=C3)O)O)O
Synonyms: Isochlorogenic acid C; 57378-72-0; 4,5-Dicaffeoylquinic acid; 4,5-Di-O-caffeoylquinic acid; 3,4-DICQA; 89886-30-6; Isochlorogenic acid C(4,5); UNII-E57A0DKE0B; …
Botanical Source: Lonicera japonica Thunb.
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