(Q105151505)

English

[(2S,3R)-1-[[(3S)-1-hydroxy-2-oxoazepan-3-yl]amino]-2-methyl-1-oxododecan-3-yl] (2R)-6-[acetyl(hydroxy)amino]-2-[[2-(2-hydroxyphenyl)-1,3-oxazole-4-carbonyl]amino]hexanoate

chemical compound

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instance of

type of chemical entity

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729.39489296 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₃₇H₅₅N₅O₁₀

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canonical SMILES

CCCCCCCCCC(OC(=O)C(CCCCN(O)C(C)=O)NC(=O)c1coc(-c2ccccc2O)n1)C(C)C(=O)NC1CCCCN(O)C1=O

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isomeric SMILES

CCCCCCCCC[C@@H](OC(=O)[C@@H](CCCCN(O)C(C)=O)NC(=O)c1coc(-c2ccccc2O)n1)[C@H](C)C(=O)N[C@H]1CCCCN(O)C1=O

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found in taxon

Nocardia

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stated in

Nocardimicins A, B, C, D, E, and F, siderophores with muscarinic M3 receptor inhibiting activity from Nocardia sp. TP-A0674.

Identifiers

InChI

InChI=1S/C37H55N5O10/c1-4-5-6-7-8-9-10-21-32(25(2)33(45)38-28-18-13-16-23-42(50)36(28)47)52-37(48)29(19-14-15-22-41(49)26(3)43)39-34(46)30-24-51-35(40-30)27-17-11-12-20-31(27)44/h11-12,17,20,24-25,28-29,32,44,49-50H,4-10,13-16,18-19,21-23H2,1-3H3,(H,38,45)(H,39,46)/t25-,28-,29+,32+/m0/s1

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InChIKey

LGOZXNLEMXJIMS-GLKSPMIPSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q105151505)

[(2S,3R)-1-[[(3S)-1-hydroxy-2-oxoazepan-3-yl]amino]-2-methyl-1-oxododecan-3-yl] (2R)-6-[acetyl(hydroxy)amino]-2-[[2-(2-hydroxyphenyl)-1,3-oxazole-4-carbonyl]amino]hexanoate

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