
| CAS Number | 3597-45-3 |
| Catalog Number | AG00C9K9(AGN-PC-0RBFP6) |
| Chemical Name | cortienic acid |
| IUPAC Name | (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid |
| InChI | InChI=1S/C20H28O5/c1-18-7-5-12(21)9-11(18)3-4-13-14-6-8-20(25,17(23)24)19(14,2)10-15(22)16(13)18/h9,13-16,22,25H,3-8,10H2,1-2H3,(H,23,24)/t13-,14-,15-,16+,18-,19-,20-/m0/s1 |
| InChI Key | XNZSRYSTBKQWGZ-XLXYOEISSA-N |
| MDL Number | MFCD00271241 |
| Molecular Formula | C20H28O5 |
| Molecular Weight | 348.4333 |
| SMILES | C[C@]12CCC(=O)C=C1CC[C@H]3[C@@H]4CC[C@](O)(C(=O)O)[C@@]4(C)C[C@H](O)[C@H]23 |
| UNII | 81738132XU |
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