BE-32030E (CHEBI:224607)

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CHEBI:224607 - BE-32030E

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ChEBI ID	CHEBI:224607
ChEBI Name	BE-32030E
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C41H63N5O11
Net Charge	0
Average Mass	801.979
Monoisotopic Mass	801.45241
SMILES	CCCCCCCC/C=C\CCCC(=O)N(O)CCCCC(NC(=O)C1(C)COC(c2cccc(O)c2O)=N1)C(=O)OC(C)CC(=O)NC1CCCCN(O)C1=O
InChI	InChI=1S/C41H63N5O11/c1-4-5-6-7-8-9-10-11-12-13-14-24-35(49)45(54)25-17-16-22-32(39(52)57-29(2)27-34(48)42-31-21-15-18-26-46(55)38(31)51)43-40(53)41(3)28-56-37(44-41)30-20-19-23-33(47)36(30)50/h11-12,19-20,23,29,31-32,47,50,54-55H,4-10,13-18,21-22,24-28H2,1-3H3,(H,42,48)(H,43,53)/b12-11-
InChIKey	KNXKXYRFAFSUQI-QXMHVHEDSA-N

Species of Metabolite	Component	Source	Comments
Nocardia (ncbitaxon:1817)	-	PubMed (9402985)

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	BE-32030E (CHEBI:224607) is a peptide (CHEBI:16670)

IUPAC Name
[4-[(1-hydroxy-2-oxoazepan-3-yl)amino]-4-oxobutan-2-yl] 2-[[2-(2,3-dihydroxyphenyl)-4-methyl-5H-1,3-oxazole-4-carbonyl]amino]-6-[hydroxy-[(Z)-tetradec-5-enoyl]amino]hexanoate

Manual Xrefs	Databases
78444231	ChemSpider