(+)-minovincinine (CHEBI:145195)

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CHEBI:145195 - (+)-minovincinine

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ChEBI ID	CHEBI:145195
ChEBI Name	(+)-minovincinine
Stars
Definition	A monoterpenoid indole alkaloid that is (+)-vincadifformine which carries a hydroxy group at position 19S. A natural product found in several plant species including Alstonia venenata and Catharanthus trichophyllus.
Last Modified	24 October 2019
Submitter	Adnan
Downloads	Molfile

Formula	C21H26N2O3
Net Charge	0
Average Mass	354.450
Monoisotopic Mass	354.19434
SMILES	[H][C@@]12N3CCC[C@]1([C@H](C)O)CC(C(=O)OC)=C1Nc4ccccc4[C@]12CC3
InChI	InChI=1S/C21H26N2O3/c1-13(24)20-8-5-10-23-11-9-21(19(20)23)15-6-3-4-7-16(15)22-17(21)14(12-20)18(25)26-2/h3-4,6-7,13,19,22,24H,5,8-12H2,1-2H3/t13-,19+,20+,21+/m0/s1
InChIKey	BKMGDPNQILJWLI-ODVVLEEXSA-N

Species of Metabolite	Component	Source	Comments
Alstonia venenata (ncbitaxon:994907)	-	Article (Book: Buckingham, J et al. Dictionary of Alkaloids with CD-ROM, 2010, pg 1311)
Catharanthus trichophyllus (ncbitaxon:319559)	-	DOI (10.1016/S0031-9422(00)98066-X)	Found in hairy root.

Roles Classification

Chemical Role:	Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology

Outgoing Relation(s)
	(+)-minovincinine (CHEBI:145195) has role plant metabolite (CHEBI:76924)
	(+)-minovincinine (CHEBI:145195) is a Aspidosperma alkaloid (CHEBI:142772)
	(+)-minovincinine (CHEBI:145195) is a alkaloid ester (CHEBI:38481)
	(+)-minovincinine (CHEBI:145195) is a methyl ester (CHEBI:25248)
	(+)-minovincinine (CHEBI:145195) is a monoterpenoid indole alkaloid (CHEBI:65323)
	(+)-minovincinine (CHEBI:145195) is a organic heteropentacyclic compound (CHEBI:38164)
	(+)-minovincinine (CHEBI:145195) is a secondary alcohol (CHEBI:35681)
	(+)-minovincinine (CHEBI:145195) is a secondary amino compound (CHEBI:50995)
	(+)-minovincinine (CHEBI:145195) is a tertiary amino compound (CHEBI:50996)
	(+)-minovincinine (CHEBI:145195) is conjugate base of (+)-minovincinine(1+) (CHEBI:144371)
	(+)-minovincinine (CHEBI:145195) is enantiomer of (−)-minovincinine (CHEBI:6941)
Incoming Relation(s)
	(+)-minovincinine(1+) (CHEBI:144371) is conjugate acid of (+)-minovincinine (CHEBI:145195)
	(−)-minovincinine (CHEBI:6941) is enantiomer of (+)-minovincinine (CHEBI:145195)

IUPAC Name
methyl (20S)-20-hydroxy-2,3-didehydroaspidospermidine-3-carboxylate

Synonym	Source
19S-hydroxy-(+)-vincadifformine	ChEBI

Manual Xrefs	Databases
C00024459	KNApSAcK

Registry Numbers	Sources
CAS:6801-25-8	ChEBI

Citations