input word = C00021417

Metabolite InformationStructural formula
Name Carota-1,4-beta-oxide
Formula C15H26O
Mw 222.19836545
CAS RN 56484-24-3
C_ID C00021417 ,
InChIKey WABYSPBNXHXFIQ-WJRNRPMQNA-N
InChICode InChI=1S/C15H26O/c1-11(2)12-5-6-13(3)7-8-14(4)9-10-15(12,13)16-14/h11-12H,5-10H2,1-4H3/t12-,13-,14-,15+/m1/s1
SMILES [C@@]12([C@]3(CC[C@@](CC1)(O3)C)[C@H](CC2)C(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeDaucus carota Ref.
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