Penazaphilone A

AlkaPlorer ID: AK326703

Synonym: None

IUPAC Name: 2-[(7S)-7-acetyloxy-5-chloro-3-[(5S)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxoisoquinolin-2-yl]-4-methylpentanoic acid

Structure

SMILES: CC[C@H](C)C=C(C)C=CC1=CC2=C(Cl)C(=O)[C@@](C)(OC(C)=O)C(=O)C2=CN1C(CC(C)C)C(=O)O

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InChI: InChI=1S/C27H34ClNO6/c1-8-16(4)12-17(5)9-10-19-13-20-21(14-29(19)22(26(33)34)11-15(2)3)24(31)27(7,35-18(6)30)25(32)23(20)28/h9-10,12-16,22H,8,11H2,1-7H3,(H,33,34)/t16-,22?,27-/m0/s1

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InChIKey: CNZFWLBJCSNNHK-SOKXFTHGSA-N

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Source

Properties Information

Molecule Weight: 504.0230000000003

TPSA: 100.98

MolLogP: 5.084200000000005

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information