input word = C00050573

Metabolite InformationStructural formula
Name Danshenxinkun C
Formula C16H12O3
Mw 252.07864425
CAS RN 65907-77-9
C_ID C00050573
InChIKey PYKVMQZMVZAUQN-UHFFFAOYSA-N
InChICode InChI=1S/C16H12O3/c1-8-4-3-5-11-10(8)6-7-12-13(11)16(19)15(18)9(2)14(12)17/h3-7,18H,1-2H3
SMILES CC1=C(O)C(=O)c2c(ccc3c(C)cccc23)C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia miltiorrhiza Ref.
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OrganismSalvia miltiorrhiza
ReferenceFang, et al., Huaxue Xuebao, 34, (1976), 197.

Sun, et al., Brief Handbook of Natural Active Compounds, Medicinal Science and Technology Press of China, Beijing, (1998).