Penazaphilone D

AlkaPlorer ID: AK326706

Synonym: None

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

Structure

SMILES: CC[C@H](C)C=C(C)C=CC1=CC2=C(Cl)C(=O)[C@@](C)(OC(C)=O)C(=O)C2=CN1CCCC(=N)O

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InChI: InChI=1S/C25H31ClN2O5/c1-6-15(2)12-16(3)9-10-18-13-19-20(14-28(18)11-7-8-21(27)30)23(31)25(5,33-17(4)29)24(32)22(19)26/h9-10,12-15H,6-8,11H2,1-5H3,(H2,27,30)/t15-,25-/m0/s1

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InChIKey: SXXGKYHZSMYCJR-MQNRADLISA-N

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Source

Properties Information

Molecule Weight: 474.9850000000003

TPSA: 107.76

MolLogP: 4.900370000000004

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information