Vibriobactin
Molecular Formula:
C35H39N5O11
InChI: InChI=1/C35H39N5O11/c1-18-26(38-33(50-18)21-9-4-12-24(42)29(21)45)32(48)37-15-7-17-40(16-6-14-36-31(47)20-8-3-11-23(41)28(20)44)35(49)27-19(2)51-34(39-27)22-10-5-13-25(43)30(22)46/h3-5,8-13,18-19,26-27,38-39,41-44H,6-7,14-17H2,1-2H3,(H,36,47)(H,37,48)/b33-21-,34-22-/t18-,19+,26+,27-/m0/s1/f/h36-37H
InChIKey: InChIKey=SNUNDXZQRUCXRW-VUOGRINADJ
SMILES: CC1C(NC(=C2C=CC=C(C2=O)O)O1)C(=O)NCCCN(CCCNC(=O)C3=C(C(=CC=C3)O)O)C(=O)C4C(OC(=C5C=CC=C(C5=O)O)N4)C
Names:
C06769
Vibriobactin
(2Z,4S,5R)-N-[3-[(2,3-dihydroxybenzoyl)amino]propyl]-2-(5-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)-N-[3-[[(2Z,4R,5S)-2-(5-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)-5-methyl-1,3-oxazolidine-4-carbonyl]amino]propyl]-5-methyl-1,3-oxazolidine-4-carboxamide
88217-23-6
Registries:
PubChem CID 5462333
PubChem ID 8989
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