input word = C00021878

Metabolite InformationStructural formula
Name Rotundenol
Formula C15H24O
Mw 220.18271539
CAS RN 65128-09-8
C_ID C00021878 ,
InChIKey SYLZYWQELDUCLB-UHFFFAOYNA-N
InChICode InChI=1S/C15H24O/c1-9-4-5-13-12(9)8-11-6-7-15(13,3)14(16)10(11)2/h9,11-14,16H,2,4-8H2,1,3H3/t9-,11-,12+,13-,14-,15+/m0/s1
SMILES C1[C@@H]([C@@H]2[C@H](C1)[C@]1(CC[C@@H](C2)C(=C)[C@@H]1O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCyperaceaeCyperus rotundus L. Ref.
PlantaeCyperaceaeCyperus scariosus Ref.
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