(1S,2R,5S,10S,11S,14S,15S)-14-[(1S)-1-aminoethyl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-en-5-amine
AlkaPlorer ID: AK003760
Synonym: None
IUPAC Name: (3S,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine
Structure
SMILES: C[C@H](N)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](N)CC[C@]4(C)[C@H]3CC[C@]12C
InChI: InChI=1S/C21H36N2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,13,15-19H,5-12,22-23H2,1-3H3/t13-,15-,16-,17+,18-,19-,20-,21+/m0/s1
InChIKey: XDELLWIDOQOKHV-YZXCLFAISA-N
Source
Properties Information
Molecule Weight: 316.5330000000001
TPSA？: 52.04
MolLogP？: 4.239900000000003
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 4
Activities Information
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