Formadicins; Formadicin D

AlkaPlorer ID: AK298498

Synonym: TAN 585D, Antibiotic TAN 585D

IUPAC Name: 2-amino-4-[4-[2-[[1-[carboxy-(4-hydroxyphenyl)methyl]-2-oxoazetidin-3-yl]amino]-1-formamido-2-oxoethyl]phenoxy]butanoic acid

Structure

SMILES: NC(CCOC1=CC=C(C(NC=O)C(=O)NC2CN(C(C(=O)O)C3=CC=C(O)C=C3)C2=O)C=C1)C(=O)O

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InChI: InChI=1S/C24H26N4O9/c25-17(23(33)34)9-10-37-16-7-3-13(4-8-16)19(26-12-29)21(31)27-18-11-28(22(18)32)20(24(35)36)14-1-5-15(30)6-2-14/h1-8,12,17-20,30H,9-11,25H2,(H,26,29)(H,27,31)(H,33,34)(H,35,36)

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InChIKey: IQYXUENJMSFELH-UHFFFAOYSA-N

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Reference

PubChem CID: 85130003

CAS: 99124-80-8

COCONUT: CNP0283692.3

Source

Species Genus Family Order Class Phylum Kingdom Domain
None Flexibacter Flexibacteraceae Cytophagales Cytophagia Bacteroidota None Bacteria

Properties Information

Molecule Weight: 514.4910000000002

TPSA: 208.58999999999995

MolLogP: -0.4869999999999984

Number of H-Donors: 6

Number of H-Acceptors: 8

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information