Perivine
AlkaPlorer ID: AK309808
Synonym: Methyl 4-demethyl-3-oxovobasan-17-oate
IUPAC Name: methyl (15E)-15-ethylidene-12-oxo-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate
Structure
SMILES: C/C=C1/CNC2CC3=C(NC4=CC=CC=C34)C(=O)CC1C2C(=O)OC
InChI: InChI=1S/C20H22N2O3/c1-3-11-10-21-16-8-14-12-6-4-5-7-15(12)22-19(14)17(23)9-13(11)18(16)20(24)25-2/h3-7,13,16,18,21-22H,8-10H2,1-2H3/b11-3-
InChIKey: NKTORRNHKYVXSU-JYOAFUTRSA-N
Source
Properties Information
Molecule Weight: 338.40700000000004
TPSA？: 71.19
MolLogP？: 2.620300000000001
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 4
Activities Information
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