input word = C00040108

Metabolite InformationStructural formula
Name Ptychonal
Formula C20H28O3
Mw 316.20384476
CAS RN 1058669-48-9
C_ID C00040108 ,
InChIKey KEDXVKFUBLMMFP-XSLRWAFZNA-N
InChICode InChI=1S/C20H28O3/c1-14-5-4-6-18-19(14,3)11-17(22)15(2)20(18,13-21)9-7-16-8-10-23-12-16/h5,8,10,12-13,15,17-18,22H,4,6-7,9,11H2,1-3H3/t15-,17-,18+,19+,20-/m1/s1
SMILES C1C=C([C@]2([C@H](C1)[C@]([C@@H]([C@@H](C2)O)C)(CCc1cocc1)C=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOlacaceaePtychopetalum olacoides Ref.
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