CHEBI:135461 - tretoquinol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name tretoquinol
ChEBI ID CHEBI:135461
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H23NO5
Net Charge 0
Average Mass 345.390
Monoisotopic Mass 345.15762
InChI InChI=1S/C19H23NO5/c1-23-17-7-11(8-18(24-2)19(17)25-3)6-14-13-10-16(22)15(21)9-12(13)4-5-20-14/h7-10,14,20-22H,4-6H2,1-3H3/t14-/m0/s1
InChIKey RGVPOXRFEPSFGH-AWEZNQCLSA-N
SMILES C(C1=CC(OC)=C(C(=C1)OC)OC)[C@H]2C=3C(=CC(=C(C3)O)O)CCN2
ChEBI Ontology
Outgoing tretoquinol (CHEBI:135461) is a isoquinolines (CHEBI:24922)
Synonyms Sources
(S)-Trimetoquinol DrugCentral
L-Tretoquinol DrugCentral
Manual Xref Database
2723 DrugCentral
View more database links
Registry Number Type Source
30418-38-3 CAS Registry Number DrugCentral
Last Modified
23 February 2017