1-[(1R,2R,10R,12R,15S,17R,20R)-17-hydroxy-1,16,16,20-tetramethyl-9-azapentacyclo[10.8.0.0²,¹⁰.0³,⁸.0¹⁵,²⁰]icosa-3(8),4,6-trien-9-yl]ethanone
AlkaPlorer ID: AK141302
Synonym: None
IUPAC Name: 1-[(1S,2S,10S,12S,15R,17R,20S)-17-hydroxy-1,16,16,20-tetramethyl-9-azapentacyclo[10.8.0.02,10.03,8.015,20]icosa-3,5,7-trien-9-yl]ethanone
Structure
SMILES: CC(=O)N1C2=CC=CC=C2[C@H]2[C@@H]1C[C@@H]1CC[C@H]3C(C)(C)[C@H](O)CC[C@]3(C)[C@@]12C
InChI: InChI=1S/C25H35NO2/c1-15(27)26-18-9-7-6-8-17(18)22-19(26)14-16-10-11-20-23(2,3)21(28)12-13-24(20,4)25(16,22)5/h6-9,16,19-22,28H,10-14H2,1-5H3/t16-,19-,20-,21+,22-,24-,25-/m0/s1
InChIKey: HYHMLCRZYUVWEE-STXUARTDSA-N
Source
Properties Information
Molecule Weight: 381.5600000000002
TPSA？: 40.540000000000006
MolLogP？: 5.128700000000006
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 5
Activities Information
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