Serratiochelin A

AlkaPlorer ID: AK047225

Synonym: None

IUPAC Name: (4S,5R)-N-[3-[(2,3-dihydroxybenzoyl)amino]propyl]-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxamide

Structure

SMILES: C[C@H]1OC(C2=CC=CC(O)=C2O)=N[C@@H]1C(=O)NCCCNC(=O)C1=CC=CC(O)=C1O

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InChI: InChI=1S/C21H23N3O7/c1-11-16(24-21(31-11)13-6-3-8-15(26)18(13)28)20(30)23-10-4-9-22-19(29)12-5-2-7-14(25)17(12)27/h2-3,5-8,11,16,25-28H,4,9-10H2,1H3,(H,22,29)(H,23,30)/t11-,16+/m1/s1

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InChIKey: QSJOEQXFYCTBSY-BZNIZROVSA-N

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Source

Properties Information

Molecule Weight: 429.4290000000002

TPSA: 160.70999999999998

MolLogP: 0.9791999999999994

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