CHEBI:84962 - 13-hydroxy-α-tocopherol

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ChEBI Name 13-hydroxy-α-tocopherol
ChEBI ID CHEBI:84962
ChEBI ASCII Name 13-hydroxy-alpha-tocopherol
Definition A member of the class of chromanols that is (+)-α-tocopherol bearing an additional hydroxy substituent at position 13'.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter laimo
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C29H50O3
Net Charge 0
Average Mass 446.70550
Monoisotopic Mass 446.37600
InChI InChI=1S/C29H50O3/c1-20(13-9-14-22(3)19-30)11-8-12-21(2)15-10-17-29(7)18-16-26-25(6)27(31)23(4)24(5)28(26)32-29/h20-22,30-31H,8-19H2,1-7H3/t20-,21+,22?,29+/m0/s1
InChIKey URYLCCKXLNXSRS-XIRVVSDESA-N
SMILES CC(CO)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCc2c(C)c(O)c(C)c(C)c2O1
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: PubMed
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 13-hydroxy-α-tocopherol (CHEBI:84962) has functional parent (R,R,R)-α-tocopherol (CHEBI:18145)
13-hydroxy-α-tocopherol (CHEBI:84962) has role human metabolite (CHEBI:77746)
13-hydroxy-α-tocopherol (CHEBI:84962) is a chromanol (CHEBI:23229)
13-hydroxy-α-tocopherol (CHEBI:84962) is a phenols (CHEBI:33853)
13-hydroxy-α-tocopherol (CHEBI:84962) is a primary alcohol (CHEBI:15734)
IUPAC Name
(2R)-2-[(4R,8S)-13-hydroxy-4,8,12-trimethyltridecyl]-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-ol
Synonyms Sources
13'-Hydroxy-alpha-tocopherol HMDB
13-hydroxy-α-tocopherol UniProt
13-OH-alpha-tocopherol SUBMITTER
2-(13-Hydroxy-4,8,12-trimethyltridecyl)-6-hydroxy-2,5,7,8-tetramethylchroman HMDB
Manual Xrefs Databases
CPD-11960 MetaCyc
HMDB0012559 HMDB
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Last Modified
20 April 2015