CHEBI:195379 - (S)-tetrahydropapaverine

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ChEBI Name (S)-tetrahydropapaverine
ChEBI ID CHEBI:195379
ChEBI ASCII Name (S)-tetrahydropapaverine
Definition The S-enantiomer of tetrahydropapaverine.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C20H25NO4
Net Charge 0
Average Mass 343.423
Monoisotopic Mass 343.17836
InChI InChI=1S/C20H25NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-6,10-12,16,21H,7-9H2,1-4H3/t16-/m0/s1
InChIKey YXWQTVWJNHKSCC-INIZCTEOSA-N
SMILES COC1=CC=C(C[C@@H]2NCCC3=C2C=C(OC)C(OC)=C3)C=C1OC
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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 (S)-tetrahydropapaverine (CHEBI:195379) is a 1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline (CHEBI:195380)
(S)-tetrahydropapaverine (CHEBI:195379) is enantiomer of (R)-tetrahydropapaverine (CHEBI:136735)
Incoming (RS)-tetrahydropapaverine (CHEBI:195381) has part (S)-tetrahydropapaverine (CHEBI:195379)
(R)-tetrahydropapaverine (CHEBI:136735) is enantiomer of (S)-tetrahydropapaverine (CHEBI:195379)
IUPAC Name
(1S)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Synonyms Sources
(−)-tetrahydropapaverine ChEBI
(S)-norlaudanosine ChEBI
Manual Xrefs Databases
C00027154 KNApSAcK
C21631 KEGG COMPOUND
S9T PDBeChem
View more database links
Registry Number Type Source
4747-98-2 CAS Registry Number KNApSAcK
Citations Waiting for Citations Types Sources
22535422 PubMed citation Europe PMC
23118227 PubMed citation Europe PMC
Last Modified
17 July 2023