CHEBI:2538 - alangiside

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ChEBI Name alangiside
ChEBI ID CHEBI:2538
Definition An organic heterotetracyclic compound that is an alkaloidal glycoside isolated from Alangium salviifolium.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C25H31NO10
Net Charge 0
Average Mass 505.51438
Monoisotopic Mass 505.19480
InChI InChI=1S/C25H31NO10/c1-3-12-14-7-16-13-8-17(28)18(33-2)6-11(13)4-5-26(16)23(32)15(14)10-34-24(12)36-25-22(31)21(30)20(29)19(9-27)35-25/h3,6,8,10,12,14,16,19-22,24-25,27-31H,1,4-5,7,9H2,2H3/t12?,14-,16-,19-,20-,21+,22-,24+,25+/m1/s1
InChIKey BCYNGTTVQNJTCV-KFWOGKQRSA-N
SMILES [H][C@]12C[C@@]3([H])N(CCc4cc(OC)c(O)cc34)C(=O)C1=CO[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C2C=C
Metabolite of Species Details
Alangium javanicum (NCBI:txid1504380) See: PubMed
Alangium grisolleoides (NCBI:txid616979) See: PubMed
Alangium salviifolium (NCBI:txid616984) See: PubMed
Roles Classification
Biological Role(s): 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.
(via alkaloid )
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ChEBI Ontology
Outgoing alangiside (CHEBI:2538) has role plant metabolite (CHEBI:76924)
alangiside (CHEBI:2538) is a β-D-glucoside (CHEBI:22798)
alangiside (CHEBI:2538) is a aromatic ether (CHEBI:35618)
alangiside (CHEBI:2538) is a isoquinoline alkaloid (CHEBI:24921)
alangiside (CHEBI:2538) is a isoquinolines (CHEBI:24922)
alangiside (CHEBI:2538) is a olefinic compound (CHEBI:78840)
alangiside (CHEBI:2538) is a organic heterotetracyclic compound (CHEBI:38163)
alangiside (CHEBI:2538) is a phenols (CHEBI:33853)
alangiside (CHEBI:2538) is a terpene glycoside (CHEBI:61777)
IUPAC Name
(11S,12aR,13aR)-12-ethenyl-11-(β-D-glucopyranosyloxy)-2-hydroxy-3-methoxy-5,6,12,12a,13,13a-hexahydro-11H-pyrano[4',3':4,5]pyrido[2,1-a]isoquinolin-8-one
Synonym Source
Alangiside KEGG COMPOUND
Manual Xrefs Databases
C00001798 KNApSAcK
C09330 KEGG COMPOUND
View more database links
Registry Number Type Source
34482-51-4 CAS Registry Number KEGG COMPOUND
Citations Waiting for Citations Types Sources
1171883 PubMed citation Europe PMC
16124751 PubMed citation Europe PMC
Last Modified
04 February 2015