CHEBI:48562 - rauwolscine

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ChEBI Name rauwolscine
ChEBI ID CHEBI:48562
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C21H26N2O3
Net Charge 0
Average Mass 354.44282
InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15+,17+,18+,19+/m1/s1
InChIKey BLGXFZZNTVWLAY-DIRVCLHFSA-N
SMILES [H][C@]12CC[C@H](O)[C@@H](C(=O)OC)[C@@]1([H])C[C@]1([H])N(CCc3c1[nH]c1ccccc31)C2
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 rauwolscine (CHEBI:48562) is a methyl 17-hydroxy-20ξ-yohimban-16-carboxylate (CHEBI:48565)
IUPAC Name
methyl 17α-hydroxy-20α-yohimban-16β-carboxylate
Synonyms Sources
17α-hydroxy-20α-yohimban-16β-carboxylic acid methyl ester ChemIDplus
α-yohimbine ChemIDplus
corynanthidine IUPHAR
isoyohimbine IUPHAR
mesoyohimbine IUPHAR
methyl (16β,17α,20α)-17-hydroxyyohimban-16-carboxylate ChemIDplus
rauwolscine IUPHAR
Database Link Database
LSM-15381 LINCS
View more database links
Registry Numbers Types Sources
131-03-3 CAS Registry Number ChemIDplus
97277 Beilstein Registry Number Beilstein
Last Modified
25 February 2016