$96.00
| CAS No.: | 23725-05-5 |
| Molecular Formula | C₁₄H₁₂O₁₁ |
| Molecular Weight | 356.24g/mol |
| Purity | HPLC>98% |
| Chemical Family | Phenols |
| Weight |
|---|
IUPAC Name: (2S)-2-[(3S,4S)-3-carboxy-5,6,7-trihydroxy-1-oxo-3,4-dihydroisochromen-4-yl]butanedioic acid
InChI: InChI=1S/C14H12O11/c15-5-1-4-7(10(19)9(5)18)8(3(12(20)21)2-6(16)17)11(13(22)23)25-14(4)24/h1,3,8,11,15,18-19H,2H2,(H,16,17)(H,20,21)(H,22,23)/t3-,8-,11-/m0/s1
InChIKey: COZMWVAACFYLBI-XJEVXTIOSA-N
Canonical SMILES: C1=C2C(=C(C(=C1O)O)O)C(C(OC2=O)C(=O)O)C(CC(=O)O)C(=O)O
Isomeric SMILES: C1=C2C(=C(C(=C1O)O)O)[C@@H]([C@H](OC2=O)C(=O)O)[C@H](CC(=O)O)C(=O)O
Synonyms: Chebulic acid; 23725-05-5; (S)-2-((3S,4S)-3-Carboxy-5,6,7-trihydroxy-1-oxoisochroman-4-yl)succinic acid; (2S)-2-[(3S,4S)-3-carboxy-5,6,7-trihydroxy-1-oxo-3,4-dihydroisochromen-4-yl]butanedioic acid; (2S)-2-[(3S)-3,4-Dihydro-3alpha-carboxy-5,6,7-trihydroxy-1-oxo-1H-2-benzopyran-4beta-yl]butanedioic acid; CHEMBL4129076; HY-N4170; YAA72505; …
Botanical Source: Chebulae Fructus
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