CHEBI:67961 - Conoideocrellide C

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ChEBI Name Conoideocrellide C
ChEBI ID CHEBI:67961
Definition A natural product found in Conoideocrella tenuis.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C41H51N5O11
Net Charge 0
Average Mass 789.87050
Monoisotopic Mass 789.35851
InChI InChI=1S/C41H51N5O11/c1-25(2)18-19-57-31-16-12-29(13-17-31)21-33(41(55)56-4)45-39(53)34(24-47)46-38(52)32(20-28-10-14-30(48)15-11-28)44-36(50)23-42-37(51)26(3)43-40(54)35(49)22-27-8-6-5-7-9-27/h5-18,26,32-35,47-49H,19-24H2,1-4H3,(H,42,51)(H,43,54)(H,44,50)(H,45,53)(H,46,52)/t26-,32+,33+,34+,35-/m0/s1
InChIKey VJMAOWJFPIPCSB-VSGSCEHBSA-N
SMILES COC(=O)[C@@H](Cc1ccc(OCC=C(C)C)cc1)NC(=O)[C@@H](CO)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](O)Cc1ccccc1
Metabolite of Species Details
Conoideocrella tenuis (NCBI:txid1105321) Found in mycelium (BTO:0001436). Filtrate of mycelia macerated with methanol of strain BCC 18627 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 )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Conoideocrellide C (CHEBI:67961) has role metabolite (CHEBI:25212)
Conoideocrellide C (CHEBI:67961) is a peptide (CHEBI:16670)
Citation Waiting for Citations Type Source
21473608 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:alpha-amino acid ester(CHEBI:46874); ISA:N-acyl-amino acid(CHEBI:51569); ISA:amino acid amide(CHEBI:22475); ISA:amphetamines(CHEBI:35338); ISA:amine(CHEBI:32952); ISA:aromatic ether(CHEBI:35618); ISA:aralkylamine(CHEBI:18000); ISA:fatty acid ester(CHEBI:35748); ISA:phenols(CHEBI:33853); ISA:fatty amide(CHEBI:29348); ISA:amino alcohol(CHEBI:22478); ISA:carboxylic ester(CHEBI:33308); ISA:carboxamide(CHEBI:37622); ISA:secondary alcohol(CHEBI:35681); ISA:polyol(CHEBI:26191); ISA:monocarboxylic acid(CHEBI:25384); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:organic heterocyclic compound(CHEBI:24532); ISA:primary alcohol(CHEBI:15734); ISA:aromatic alcohol(CHEBI:33854); ISA:carbonyl compound(CHEBI:36586);