input word = C00021392

Metabolite InformationStructural formula
Name Carotdiol veratrate
Formula C24H34O5
Mw 402.2406242
CAS RN 122769-23-7
C_ID C00021392 ,
InChIKey FRTKCHBXZYXDGA-QIKSWSGPNA-N
InChICode InChI=1S/C24H34O5/c1-15(2)18-10-12-23(4)11-9-16(3)21(14-24(18,23)26)29-22(25)17-7-8-19(27-5)20(13-17)28-6/h7-9,13,15,18,21,26H,10-12,14H2,1-6H3/t18-,21-,23+,24+/m1/s1
SMILES [C@@]12([C@](C[C@H](C(=CC1)C)OC(=O)c1cc(c(cc1)OC)OC)([C@H](CC2)C(C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula linkii Ref.
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OrganismFerula linkii
ReferenceFraga,Phytochem.,28,(1989),1649