Althiomycin

AlkaPlorer ID: AK284071

Synonym: Matamycin, Antibiotic 116A

IUPAC Name: 2-(hydroxyiminomethyl)-N-[2-hydroxy-1-[4-(3-methoxy-5-oxo-2H-pyrrole-1-carbonyl)-4,5-dihydro-1,3-thiazol-2-yl]ethyl]-1,3-thiazole-4-carboxamide

Structure

SMILES: COC1=CC(=O)N(C(=O)C2CSC(C(CO)NC(=O)C3=CSC(C=NO)=N3)=N2)C1

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InChI: InChI=1S/C16H17N5O6S2/c1-27-8-2-13(23)21(4-8)16(25)11-7-29-15(20-11)9(5-22)19-14(24)10-6-28-12(18-10)3-17-26/h2-3,6,9,11,22,26H,4-5,7H2,1H3,(H,19,24)

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InChIKey: VQQNQKXWJMRPHT-UHFFFAOYSA-N

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Reference

PubChem CID: 73420

CAS: 12656-40-5

COCONUT: CNP0333274.1

Properties Information

Molecule Weight: 439.4750000000002

TPSA: 153.78000000000003

MolLogP: -0.5450999999999999

Number of H-Donors: 3

Number of H-Acceptors: 11

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information