input word = C00064103

Metabolite InformationStructural formula
Name Valeriananoid C
Formula C17H28O3
Mw 280.20384476
CAS RN 195058-17-4
C_ID C00064103
InChIKey RAPAFGOPSFDECW-CKQPZERJSA-N
InChICode InChI=1S/C17H28O3/c1-10-6-7-17(19)15(3,4)13-8-12(10)16(17,5)9-14(13)20-11(2)18/h10,12-14,19H,6-9H2,1-5H3/t10-,12-,13-,14-,16-,17+/m0/s1
SMILES CC(=O)OC1CC2(C)C3CC1C(C)(C)C2(O)CCC3C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana jatamansi Ref.
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