input word = C00050011

Metabolite InformationStructural formula
Name Bebryazulene
Formula C15H18O
Mw 214.1357652
CAS RN 213818-05-4
C_ID C00050011 ,
InChIKey PXXJFFAUJYCTFW-QWAQRTLVNA-N
InChICode InChI=1S/C15H18O/c1-9-4-12-7-14-11(3)8-16-15(14)6-10(2)13(12)5-9/h8,12-13H,1-2,4-7H2,3H3/t12-,13+/m0/s1
SMILES C1(=C)[C@@H]2[C@H](Cc3c(C1)occ3C)CC(=C)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Bebryce grandicalyx Ref.
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