CHEBI:70427 - Buxalongifolamidine

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ChEBI Name Buxalongifolamidine
ChEBI ID CHEBI:70427
Definition A natural product found in Buxus natalensis and Buxus longifolia.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C35H50N2O5
Net Charge 0
Average Mass 578.78190
Monoisotopic Mass 578.37197
InChI InChI=1S/C35H50N2O5/c1-22(37(6)7)30-27(42-23(2)39)20-34(5)26-13-14-28-32(3,21-38)29(36-31(40)24-11-9-8-10-12-24)16-18-35(28,41)19-25(26)15-17-33(30,34)4/h8-12,15-16,18,22,26-30,38,41H,13-14,17,19-21H2,1-7H3,(H,36,40)/t22-,26+,27+,28-,29-,30-,32-,33+,34-,35-/m0/s1
InChIKey SQULXMOMDPJQNT-QCFSPYGNSA-N
SMILES [H][C@@]12CC[C@@]3([H])[C@](C)(CO)[C@@H](NC(=O)c4ccccc4)C=C[C@]3(O)CC1=CC[C@]1(C)[C@@]([H])([C@H](C)N(C)C)[C@@H](C[C@@]21C)OC(C)=O
Metabolite of Species Details
Buxus natalensis (IPNI:128681-1) Found in bark (BTO:0001301). MeOH extract of pulverized bark See: PubMed
Buxus longifolia (IPNI:340298-1) See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Buxalongifolamidine (CHEBI:70427) has role metabolite (CHEBI:25212)
Buxalongifolamidine (CHEBI:70427) is a steroid alkaloid (CHEBI:26767)
Citation Waiting for Citations Type Source
20954721 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:diterpenoid(CHEBI:23849); ISA:benzamides(CHEBI:22702); ISA:benzoic acids(CHEBI:22723); ISA:carbonyl compound(CHEBI:36586); ISA:aralkylamine(CHEBI:18000); ISA:tertiary alcohol(CHEBI:26878); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:amino alcohol(CHEBI:22478); ISA:organic hydroxy compound(CHEBI:33822); ISA:tertiary amine(CHEBI:32876); ISA:carboxylic ester(CHEBI:33308); ISA:carboxamide(CHEBI:37622); ISA:ether(CHEBI:25698); ISA:organic heterocyclic compound(CHEBI:24532); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:primary alcohol(CHEBI:15734);