CHEBI:68093 - lapidilectine B

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ChEBI Name lapidilectine B
ChEBI ID CHEBI:68093
Definition A natural product found in Kopsia grandifolia.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H22N2O4
Net Charge 0
Average Mass 366.41040
Monoisotopic Mass 366.15796
InChI InChI=1S/C21H22N2O4/c1-26-18(25)23-16-6-3-2-5-14(16)21-10-12-22-11-4-7-19(22)8-9-20(21,23)15(13-19)17(24)27-21/h2-7,15H,8-13H2,1H3/t15-,19+,20+,21+/m0/s1
InChIKey GLOIILVAVSJIEX-LWILDLIXSA-N
SMILES [H][C@@]12C[C@@]34CC[C@@]11N(C(=O)OC)c5ccccc5[C@@]1(CCN3CC=C4)OC2=O
Metabolite of Species Details
Kopsia grandifolia (IPNI:60436655-2) Found in leaf (BTO:0000713). leaf extract See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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 lapidilectine B (CHEBI:68093) has role metabolite (CHEBI:25212)
lapidilectine B (CHEBI:68093) is a indolyl carboxylic acid (CHEBI:46867)
Synonym Source
Methyl (1R,9R,12R,21R)-20-oxo-19-oxa-8,16-diazahexacyclo[10.6.4.0[1,9].0[2,7].0[9,21].0[12,16]]docosa-2,4,6,13-tetraene-8-carboxylate ChEBI
Citation Waiting for Citations Type Source
21428274 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:aralkylamine(CHEBI:18000); ISA:benzenoid aromatic compound(CHEBI:33836); ISA:dicarboxylic acid(CHEBI:35692); ISA:gamma-lactone(CHEBI:37581); ISA:carbamate ester(CHEBI:23003); ISA:oxolanes(CHEBI:26912); ISA:pyrroline(CHEBI:23763); ISA:carboxylic ester(CHEBI:33308); ISA:tertiary amine(CHEBI:32876); ISA:organonitrogen compound(CHEBI:35352); ISA:ether(CHEBI:25698); ISA:carbonyl compound(CHEBI:36586);