Petrocidin A

AlkaPlorer ID: AK010248

Synonym: None

IUPAC Name: 2,3-dihydroxy-N-[(3S,6R)-3-(2-methylpropyl)-2,5-dioxo-1,4-diazonan-6-yl]benzamide

Structure

SMILES: CC(C)C[C@@H]1N=C(O)[C@H](N=C(O)C2=CC=CC(O)=C2O)CCCN=C1O

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InChI: InChI=1S/C18H25N3O5/c1-10(2)9-13-17(25)19-8-4-6-12(18(26)21-13)20-16(24)11-5-3-7-14(22)15(11)23/h3,5,7,10,12-13,22-23H,4,6,8-9H2,1-2H3,(H,19,25)(H,20,24)(H,21,26)/t12-,13+/m1/s1

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InChIKey: HFAZSJAUKYTBFH-OLZOCXBDSA-N

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Properties Information

Molecule Weight: 363.41400000000016

TPSA: 138.23000000000002

MolLogP: 2.892500000000001

Number of H-Donors: 5

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information