Brevianamide C; (E)-Isomer
AlkaPlorer ID: AK290988
Synonym: Brevianamide D
IUPAC Name: 7-[(Z)-(3-oxo-1H-indol-2-ylidene)methyl]-11-propan-2-yl-5,8-diazatricyclo[5.2.2.01,5]undecane-6,9-dione
Structure
SMILES: CC(C)C1CC23CCCN2C(=O)C1(/C=C1\NC2=CC=CC=C2C1=O)NC3=O
InChI: InChI=1S/C21H23N3O3/c1-12(2)14-10-20-8-5-9-24(20)19(27)21(14,23-18(20)26)11-16-17(25)13-6-3-4-7-15(13)22-16/h3-4,6-7,11-12,14,22H,5,8-10H2,1-2H3,(H,23,26)/b16-11-
InChIKey: ZYQGZNMJYUPXGP-WJDWOHSUSA-N
Reference
CAS: 38136-69-5
Source
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Properties Information
Molecule Weight: 365.4330000000001
TPSA?: 78.51
MolLogP?: 2.0844
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 6
Activities Information
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