Antibiotic AB3217A

AlkaPlorer ID: AK010084

Synonym: 'Antibiotic AB3217A', 'AB 3217A', 'AB3217-A'

IUPAC Name: (1R,3S,4S,7R,8R,11R,12S,13R)-8-(4-methoxyphenyl)-2,9,14-trioxa-6-azatricyclo[9.2.1.03,7]tetradecane-4,12,13-triol

Structure

SMILES: COC1=CC=C([C@H]2OC[C@H]3O[C@@H](O[C@H]4[C@@H]2NC[C@@H]4O)[C@H](O)[C@@H]3O)C=C1

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InChI: InChI=1S/C17H23NO7/c1-22-9-4-2-8(3-5-9)15-12-16(10(19)6-18-12)25-17-14(21)13(20)11(24-17)7-23-15/h2-5,10-21H,6-7H2,1H3/t10-,11+,12+,13+,14+,15+,16+,17-/m0/s1

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InChIKey: CXOWUUUBWJFSRU-BNWDXEGFSA-N

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Source

Properties Information

Molecule Weight: 353.37100000000004

TPSA: 109.64

MolLogP: -1.0688999999999982

Number of H-Donors: 4

Number of H-Acceptors: 8

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information