CHEBI:32237 - Tocamphyl

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Tocamphyl
ChEBI ID CHEBI:32237
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formulae C19H26O4.C4H11NO2
C23H37NO6
Net Charge 0
Average Mass 423.544
Monoisotopic Mass 423.26209
InChI InChI=1S/C19H26O4.C4H11NO2/c1-12-6-8-14(9-7-12)13(2)23-17(22)19(5)11-10-15(16(20)21)18(19,3)4;6-3-1-5-2-4-7/h6-9,13,15H,10-11H2,1-5H3,(H,20,21);5-7H,1-4H2
InChIKey WSEQDEFUEFCRLT-UHFFFAOYSA-N
SMILES C(C1C(C(CC1)(C)C(OC(C2=CC=C(C=C2)C)C)=O)(C)C)(=O)O.OCCNCCO
ChEBI Ontology
Outgoing Tocamphyl (CHEBI:32237) has functional parent benzyl alcohol (CHEBI:17987)
Tocamphyl (CHEBI:32237) is a carboxylic ester (CHEBI:33308)
Synonym Source
Tocamphyl KEGG COMPOUND
Manual Xref Database
D01640 KEGG DRUG
View more database links
Registry Number Type Source
5634-42-4 CAS Registry Number KEGG COMPOUND
Last Modified
06 March 2017