CHEBI:69386 - neotuberostemonine

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ChEBI Name neotuberostemonine
ChEBI ID CHEBI:69386
Definition A natural product found in Stemona tuberosa and Stemona phyllantha.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H33NO4
Net Charge 0
Average Mass 375.50170
Monoisotopic Mass 375.24096
InChI InChI=1S/C22H33NO4/c1-4-13-14-7-5-6-8-23-16(17-9-11(2)21(24)26-17)10-15(19(14)23)18-12(3)22(25)27-20(13)18/h11-20H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16-,17-,18-,19+,20+/m0/s1
InChIKey GYOGHROCTSEKDY-UEIGSNQUSA-N
SMILES [H][C@]1(C[C@H](C)C(=O)O1)[C@]1([H])C[C@@]2([H])[C@]3([H])[C@H](C)C(=O)O[C@]3([H])[C@H](CC)[C@@]3([H])CCCCN1[C@@]23[H]
Metabolite of Species Details
Stemona tuberosa (NCBI:txid167572) Found in tuberous root (BTO:0001309). MeOH extract of dried underground parts(tuberous roots and rhizomes) See: PubMed
Stemona tuberosa (NCBI:txid167572) Found in rhizome (BTO:0001181). MeOH extract of dried underground parts(tuberous roots and rhizomes) See: PubMed
Stemona phyllantha (NCBI:txid492017) Found in rhizome (BTO:0001181). MeOH extract of dried underground parts(tuberous roots and rhizomes) See: PubMed
Stemona phyllantha (NCBI:txid492017) Found in tuberous root (BTO:0001309). MeOH extract of dried underground parts(tuberous roots and rhizomes) 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 )
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ChEBI Ontology
Outgoing neotuberostemonine (CHEBI:69386) has role metabolite (CHEBI:25212)
neotuberostemonine (CHEBI:69386) is a alkaloid (CHEBI:22315)
Synonym Source
(2S,7aR,8R,8aR,11S,11aR,11bS,11cR)-8-Ethyl-11-methyl-2-[(2S,4S)-4-methyl-5-oxotetrahydro-2-furanyl]dodecahydroazepino[3,2,1-hi]furo[3,2-e]indol-10(2H)-one ChEBI
Citation Waiting for Citations Type Source
21902195 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:alkaloid(CHEBI:22315); ISA:ferriheme a(CHEBI:36183); ISA:indoles(CHEBI:24828); ISA:azepanes(CHEBI:46986); ISA:gamma-lactone(CHEBI:37581); ISA:dicarboxylic acid(CHEBI:35692); ISA:N-alkylpyrrolidine(CHEBI:46775); ISA:oxolanes(CHEBI:26912); ISA:tertiary amine(CHEBI:32876); ISA:carboxylic ester(CHEBI:33308); ISA:ether(CHEBI:25698); ISA:carbonyl compound(CHEBI:36586);