input word = C00035791

Metabolite InformationStructural formula
Name all-rac-3,4-Dehydro-alpha-tocopherol
Formula C29H48O2
Mw 428.36543078
CAS RN 3808-26-2
C_ID C00035791 ,
InChIKey JDRGHECKJUSWSU-UHFFFAOYNA-N
InChICode InChI=1S/C29H48O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h17,19-22,30H,9-16,18H2,1-8H3/t21-,22+,29+/m0/s1
SMILES Cc1c(C)c2c(c(C)c1O)C=CC(C)(CCCC(C)CCCC(C)CCCC(C)C)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeStemonaceaeStemona burkillii Ref.
PlantaeStemonaceaeStemona collinsae Ref.
PlantaeStemonaceaeStemona curtisii Ref.
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