Beauverolide P (CHEBI:203968)

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CHEBI:203968 - Beauverolide P

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ChEBI ID	CHEBI:203968
ChEBI Name	Beauverolide P
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C25H45N3O5
Net Charge	0
Average Mass	467.651
Monoisotopic Mass	467.33592
SMILES	CCCCCC[C@H](C)[C@@H]1CC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](CC(C)C)C(=O)O1
InChI	InChI=1S/C25H45N3O5/c1-8-9-10-11-12-17(6)20-14-21(29)28-22(16(4)5)24(31)26-18(7)23(30)27-19(13-15(2)3)25(32)33-20/h15-20,22H,8-14H2,1-7H3,(H,26,31)(H,27,30)(H,28,29)/t17-,18-,19+,20-,22-/m0/s1
InChIKey	URWKWOOBBPTCLZ-OTVISBKVSA-N

Species of Metabolite	Component	Source	Comments
Beauveria (ncbitaxon:5581)	-	PubMed (11747104)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Beauverolide P (CHEBI:203968) is a cyclodepsipeptide (CHEBI:35213)

IUPAC Name
(3R,6S,9S,13S)-6-methyl-3-(2-methylpropyl)-13-[(2S)-octan-2-yl]-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

Manual Xrefs	Databases
78442581	ChemSpider