Penicillenol A1; 6-Deoxy, 5,6,6',7'-tetradehydro(5Z,6'E-)
AlkaPlorer ID: AK309570
Synonym: Penicillenol D1
IUPAC Name: (5E)-5-ethylidene-4-hydroxy-1-methyl-3-[(E)-2-methyloct-6-enoyl]pyrrol-2-one
Structure
SMILES: C/C=C/CCCC(C)/C(O)=C1\C(=O)/C(=C\C)N(C)C1=O
InChI: InChI=1S/C16H23NO3/c1-5-7-8-9-10-11(3)14(18)13-15(19)12(6-2)17(4)16(13)20/h5-7,11,18H,8-10H2,1-4H3/b7-5+,12-6+,14-13-
InChIKey: WMJFAHBPJFKTQJ-FLYAFNRNSA-N
Reference
CAS: 1687745-26-1
Source
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Properties Information
Molecule Weight: 277.36400000000003
TPSA？: 57.61
MolLogP？: 3.125900000000001
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 1
Activities Information
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