CHEBI:203133 - Nocardimicin D

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Nocardimicin D
ChEBI ID CHEBI:203133
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C41H63N5O10
Net Charge 0
Average Mass 785.980
Monoisotopic Mass 785.45749
InChI InChI=1S/C41H63N5O10/c1-4-5-6-7-8-9-10-11-12-13-14-25-36(29(2)37(49)42-32-22-17-20-27-46(54)40(32)51)56-41(52)33(23-18-19-26-45(53)30(3)47)43-38(50)34-28-55-39(44-34)31-21-15-16-24-35(31)48/h15-16,21,24,28-29,32-33,36,48,53-54H,4-14,17-20,22-23,25-27H2,1-3H3,(H,42,49)(H,43,50)
InChIKey CILDOHPTQUQJJM-UHFFFAOYSA-N
SMILES O=C1N(O)CCCCC1NC(=O)C(C(OC(=O)C(NC(=O)C=2N=C(C3=C(O)C=CC=C3)OC2)CCCCN(O)C(=O)C)CCCCCCCCCCCCC)C
Metabolite of Species Details
Nocardia (NCBI:txid1817) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Nocardimicin D (CHEBI:203133) is a depsipeptide (CHEBI:23643)
IUPAC Name
[1-[(1-hydroxy-2-oxoazepan-3-yl)amino]-2-methyl-1-oxohexadecan-3-yl] 6-[acetyl(hydroxy)amino]-2-[[2-(2-hydroxyphenyl)-1,3-oxazole-4-carbonyl]amino]hexanoate
Manual Xref Database
23326759 ChemSpider
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