CHEBI:223013 - Enniatin P2

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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 P2
ChEBI ID CHEBI:223013
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C33H57N3O10
Net Charge 0
Average Mass 655.830
Monoisotopic Mass 655.40440
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
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)CC(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 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