Tombozin
AlkaPlorer ID: AK001149
Synonym: None
IUPAC Name: [(1S,12S,14R,15Z)-15-ethylidene-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraen-13-yl]methanol
Structure
SMILES: C/C=C/1\CN2[C@H]3C[C@@H]1C([C@@H]2CC4=C3NC5=CC=CC=C45)CO
InChI: InChI=1S/C19H22N2O/c1-2-11-9-21-17-8-14-12-5-3-4-6-16(12)20-19(14)18(21)7-13(11)15(17)10-22/h2-6,13,15,17-18,20,22H,7-10H2,1H3/b11-2+/t13-,15?,17-,18-/m0/s1
InChIKey: VXTDUGOBAOLMED-JBIYAAMQSA-N
Source
Properties Information
Molecule Weight: 294.398
TPSA？: 39.260000000000005
MolLogP？: 3.0240000000000014
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 6
Activities Information
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