For research use only. Not for therapeutic Use.
| Catalog Number | R061449 |
| CAS Number | 5143-05-5 |
| Synonyms | (3β,4α)-3-Hydroxy-olean-12-ene-23,28-dioic Acid; 3β-Hydroxy-olean-12-ene-23,28-dioic Acid; Astrantiagenin J; Gypsogeninic Acid |
| Molecular Formula | C30H46O5 |
| Purity | ≥95% |
| Storage | Store at -20°C |
| IUPAC Name | (3S,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-3-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid |
| InChI | InChI=1S/C30H46O5/c1-25(2)13-15-30(24(34)35)16-14-27(4)18(19(30)17-25)7-8-20-26(3)11-10-22(31)29(6,23(32)33)21(26)9-12-28(20,27)5/h7,19-22,31H,8-17H2,1-6H3,(H,32,33)(H,34,35)/t19-,20+,21+,22-,26+,27+,28+,29-,30-/m0/s1 |
| InChIKey | PAIBKVQNJKUVCE-JUENUIDLSA-N |
| SMILES | CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C(=O)O)O)C)C)C2C1)C)C(=O)O)C |
