Tetrahydrocortisol
HIT212673412
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HIT ID: HIT212673412
Cas No: 53-02-1
分子式: C21H34O5
分子量: 366.498
常用名: Tetrahydrocortisol
氢键受体数 (HBA): 5
氢键供体数 (HBD): 4
LogP: 1.1135
IUPAC: 1-[(1R,3aS,3bS,5aR,7R,9aS,9bS,10S,11aS)-1,7,10-trihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2-hydroxyethan-1-one
IUPAC: 1-[(1R,3aS,3bS,5aR,7R,9aS,9bS,10S,11aS)-1,7,10-trihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2-hydroxyethan-1-one
SMILES: [H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@H](O)CC[C@]12C
SMILES: [H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CC[C@]2([H])C[C@H](O)CC[C@]12C
InChI key: AODPIQQILQLWGS-GXBDJPPSSA-N
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