$350.00
| CAS No.: | 17365-11-6 |
| Molecular Formula | C₁₄H₁₆O₁₀ |
| Molecular Weight | 344.27g/mol |
| Purity | HPLC>98% |
| Chemical Family | Phenols |
| Weight |
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IUPAC Name: (1S,3R,4R,5R)-1,3,4-trihydroxy-5-(3,4,5-trihydroxybenzoyl)oxycyclohexane-1-carboxylic acid
InChI: InChI=1S/C14H16O10/c15-6-1-5(2-7(16)10(6)18)12(20)24-9-4-14(23,13(21)22)3-8(17)11(9)19/h1-2,8-9,11,15-19,23H,3-4H2,(H,21,22)/t8-,9-,11-,14+/m1/s1
InChIKey: LDPLFHGGZNSKDS-FTBFGRRBSA-N
Canonical SMILES: C1C(C(C(CC1(C(=O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)O)O
Isomeric SMILES: C1[C@H]([C@H]([C@@H](C[C@@]1(C(=O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)O)O
Synonyms: Theogallin; 17365-11-6; 3-Galloylquinic acid; 3-O-Galloylquinic acid; Gallotannin 20; 3-Galloyl quinate; Benzoic acid, 3,4,5-trihydroxy-, (1R,2R,3R,5S)-5-carboxy-2,3,5-trihydroxycyclohexyl ester; Quinic acid, 3-gallate; …
Botanical Source:
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