Cortisol-17beta-acid
[CAS# 100188-36-1]

Identification

• Name: Cortisol-17beta-acid
• Synonyms: (8S,9S,10R,11S,13S,14S,17S)-11,17-Dihydroxy-3-Keto-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene-17-Carboxylic Acid; Cortisol-17 Acid; Cortisol-17Beta Acid
• Molecular Formula: C₂₀H₂₈O₅
• Molecular Weight: 348.44
• CAS Registry Number: 100188-36-1
• SMILES: [C@H]34[C@H]2[C@@H]([C@@]1(C(=CC(=O)CC1)CC2)C)[C@@H](O)C[C@@]3([C@@](O)(CC4)C(=O)O)C
• 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
• InChIKey: XNZSRYSTBKQWGZ-VHTXEEJTSA-N