CHEBI:223009 - Enniatin P1

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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 Enniatin P1
ChEBI ID CHEBI:223009
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C32H55N3O10
Net Charge 0
Average Mass 641.803
Monoisotopic Mass 641.38874
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
SMILES O=C1O[C@H](C(=O)N([C@@H](C(=O)O[C@H](C(=O)N([C@@H](C(O[C@H](C(N([C@@H]1[C@H](O)C)C)=O)C(C)C)=O)C(C)C)C)C(C)C)C(C)C)C)C(C)C
Metabolite of Species Details
Fusarium acuminatum (NCBI:txid5515) 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 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