input word = C00037545

Metabolite InformationStructural formula
Name Neocryptotanshinone II
Formula C17H18O3
Mw 270.12559444
CAS RN 278180-50-0
C_ID C00037545 ,
InChIKey NXKYAFGBRZSLBM-UHFFFAOYSA-N
InChICode InChI=1S/C17H18O3/c1-9-14(18)11-6-7-12-10(5-4-8-17(12,2)3)13(11)16(20)15(9)19/h6-7,19H,4-5,8H2,1-3H3
SMILES c12c(ccc3c1CCCC3(C)C)C(=O)C(=C(C2=O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia miltiorrhiza Ref.
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OrganismSalvia miltiorrhiza
ReferenceLin,Phytochem.,53,(2000),951