18-Oxocortisol | CAS 2410-60-8 | AnyMole

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HIT214323435

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HIT214323435

HIT ID:HIT214323435
Cas No:2410-60-8
常用名:18-Oxocortisol
IUPAC:(1R,3aS,3bS,9aR,9bS,10S,11aR)-1,10-dihydroxy-1-(2-hydroxyacetyl)-9a-methyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-11a-carbaldehyde
IUPAC:(1R,3aS,3bS,9aR,9bS,10S,11aR)-1,10-dihydroxy-1-(2-hydroxyacetyl)-9a-methyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-11a-carbaldehyde
InChI key:XUQWWIFROYJHCU-UKSDXMLSSA-N

分子式:C21H28O6
分子量:376.449
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12CC[C@](O)(C(=O)CO)[C@]1(C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C)C=O |t:22|
SMILES:[H][C@@]12CC[C@](O)(C(=O)CO)[C@]1(C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C)C=O |t:22|

18-Oxocortisol is a cortisol derivative generated by aldosterone synthase (CYP11B2). It acts as a naturally occurring mineralocorticoid agonist and serves as a biomarker in adrenal vein sampling.

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