input word = C00017476

Metabolite InformationStructural formula
Name Kanshone C
Formula C15H20O3
Mw 248.1412445
CAS RN 117634-64-7
C_ID C00017476 ,
InChIKey NGUGLLPTHUYIGI-RZAWGRMQNA-N
InChICode InChI=1S/C15H20O3/c1-7-5-6-8-15(18-8)12(17)10(16)9-11(13(9,2)3)14(7,15)4/h7-9,11H,5-6H2,1-4H3/t7-,8+,9-,11+,14-,15-/m1/s1
SMILES C[C@@H]1CC[C@@H]2O[C@@]23C(=O)C(=O)[C@@H]2[C@@H](C2(C)C)[C@@]13C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeValerianaceaeNardostachys chinensis Ref.
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