Enniatin P1 (CHEBI:223009)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:223009 - Enniatin P1

Take structure to advanced search

ChEBI ID	CHEBI:223009
ChEBI Name	Enniatin P1
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C32H55N3O10
Net Charge	0
Average Mass	641.803
Monoisotopic Mass	641.38874
SMILES	CC(C)[C@@H]1OC(=O)[C@@H](C(C)C)N(C)C(=O)[C@H](C(C)C)OC(=O)[C@@H]([C@@H](C)O)N(C)C(=O)[C@H](C(C)C)OC(=O)[C@@H](C(C)C)N(C)C1=O
InChI	InChI=1S/C32H55N3O10/c1-15(2)21-30(40)43-24(17(5)6)27(37)33(12)22(16(3)4)31(41)44-26(19(9)10)29(39)35(14)23(20(11)36)32(42)45-25(18(7)8)28(38)34(21)13/h15-26,36H,1-14H3/t20-,21-,22-,23-,24+,25+,26+/m1/s1
InChIKey	PYSCLKYQWXVQGS-ZAUVCPJUSA-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 P1 (CHEBI:223009) is a cyclodepsipeptide (CHEBI:35213)

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