Enniatin P2 (CHEBI:223013)

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CHEBI:223013 - Enniatin P2

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ChEBI ID	CHEBI:223013
ChEBI Name	Enniatin P2
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C33H57N3O10
Net Charge	0
Average Mass	655.830
Monoisotopic Mass	655.40440
SMILES	CC(C)C[C@@H]1C(=O)O[C@@H](C(C)C)C(=O)N(C)[C@H]([C@@H](C)O)C(=O)O[C@@H](C(C)C)C(=O)N(C)[C@H](C(C)C)C(=O)O[C@@H](C(C)C)C(=O)N1C
InChI	InChI=1S/C33H57N3O10/c1-16(2)15-22-31(41)44-26(19(7)8)30(40)36(14)24(21(11)37)33(43)46-27(20(9)10)29(39)35(13)23(17(3)4)32(42)45-25(18(5)6)28(38)34(22)12/h16-27,37H,15H2,1-14H3/t21-,22-,23-,24-,25+,26+,27+/m1/s1
InChIKey	YBLZDYVXSUSQNF-ZUZUSLRPSA-N

Species of Metabolite	Component	Source	Comments
Fusarium acuminatum (ncbitaxon:5515)	-	PubMed (19249325)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Enniatin P2 (CHEBI:223013) is a cyclodepsipeptide (CHEBI:35213)

IUPAC Name
(3R,6S,9R,12S,15R,18S)-3-[(1R)-1-hydroxyethyl]-4,10,16-trimethyl-9-(2-methylpropyl)-6,12,15,18-tetra(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone