CHEBI:203942 - BE-32030 E

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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 BE-32030 E
ChEBI ID CHEBI:203942
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(49)45(53)26-19-18-23-33(43-40(52)41(3)29-55-37(44-41)31-21-15-16-24-34(31)47)39(51)56-30(2)28-35(48)42-32-22-17-20-27-46(54)38(32)50/h11-12,15-16,21,24,30,32-33,47,53-54H,4-10,13-14,17-20,22-23,25-29H2,1-3H3,(H,42,48)(H,43,52)/b12-11-
InChIKey RQUNTWFQXNRDCK-QXMHVHEDSA-N
SMILES O=C1N(O)CCCCC1NC(=O)CC(OC(=O)C(NC(=O)C2(N=C(C3=C(O)C=CC=C3)OC2)C)CCCCN(O)C(=O)CCC/C=C\CCCCCCCC)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 BE-32030 E (CHEBI:203942) is a depsipeptide (CHEBI:23643)
IUPAC Name
[4-[(1-hydroxy-2-oxoazepan-3-yl)amino]-4-oxobutan-2-yl] 2-[[2-(2-hydroxyphenyl)-4-methyl-5H-1,3-oxazole-4-carbonyl]amino]-6-[hydroxy-[(Z)-tetradec-5-enoyl]amino]hexanoate
Manual Xref Database
78443642 ChemSpider
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