CHEBI:226003 - Colletotrichamide C

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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 Colletotrichamide C
ChEBI ID CHEBI:226003
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C35H56N2O11
Net Charge 0
Average Mass 680.836
Monoisotopic Mass 680.38841
InChI InChI=1S/C35H56N2O11/c1-6-20(2)29-34(45)47-26(17-24(39)18-28(40)36-25(33(44)37(29)5)16-23-14-8-7-9-15-23)21(3)12-10-11-13-22(4)46-35-32(43)31(42)30(41)27(19-38)48-35/h7-9,14-15,20-22,24-27,29-32,35,38-39,41-43H,6,10-13,16-19H2,1-5H3,(H,36,40)/t20?,21?,22-,24?,25?,26?,27-,29?,30-,31+,32+,35-/m1/s1
InChIKey HPPUILYZIHIGQH-OKMZIMIASA-N
SMILES O=C1OC(C(CCCC[C@H](O[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@@H]2O)O)CO)C)C)CC(O)CC(=O)NC(C(N(C1C(CC)C)C)=O)CC3=CC=CC=C3
Metabolite of Species Details
Colletotrichum (NCBI:txid5455) 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 Colletotrichamide C (CHEBI:226003) is a cyclodepsipeptide (CHEBI:35213)
Colletotrichamide C (CHEBI:226003) is a glycoside (CHEBI:24400)
IUPAC Name
6-benzyl-3-butan-2-yl-10-hydroxy-4-methyl-12-[(7R)-7-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctan-2-yl]-1-oxa-4,7-diazacyclododecane-2,5,8-trione