13'-hydroxy-α-tocopherol

Chemical Formula:

C₂₉H₅₀O₃

Molecular Weight:

446.712 Daltons

Monoisotopic Mass:

446.3759954713 Daltons

SMILES:

CC(CCCC(C)CO)CCCC(C)CCCC1(C)(CCC2(=C(O1)C(C)=C(C)C(O)=C(C)2))

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

InChIKey:

URYLCCKXLNXSRS-UHFFFAOYSA-N

Synonyms

Databases

MetaCyc: CPD-11960

PubChem (CID): 45479210

Seed: cpd23161

HMDB: HMDB12559

ChEBI: 84962

MetaNetX: MNXM9688