input word = C00037780

Metabolite InformationStructural formula
Name Salvianolic acid L
(-)-Salvianolic acid L
Formula C36H30O16
Mw 718.15338491
CAS RN 389065-74-1
C_ID C00037780 ,
InChIKey CLZDRNKNWXDFQT-UJYQGLSTNA-N
InChICode InChI=1S/C36H30O16/c37-20-5-1-15(9-24(20)41)11-27(33(45)46)51-35(49)19-13-17-4-8-23(40)32(44)30(17)31(29(19)18-3-7-22(39)26(43)14-18)36(50)52-28(34(47)48)12-16-2-6-21(38)25(42)10-16/h1-10,13-14,27-29,31,37-44H,11-12H2,(H,45,46)(H,47,48)/t27-,28-,29+,31-/m0/s1
SMILES O=C(O[C@@H](Cc1ccc(O)c(O)c1)C(=O)O)C1=Cc2ccc(O)c(O)c2C(C(=O)OC(Cc2ccc(O)c(O)c2)C(=O)O)C1c1ccc(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia officinalis Ref.
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OrganismSalvia officinalis
ReferenceLu,Phytochem.,59,(2002),117