input word = C00038033

Metabolite InformationStructural formula
Name Yunnaneic acid G
(-)-Yunnaneic acid G
Formula C36H30O16
Mw 718.15338491
CAS RN 199433-62-0
C_ID C00038033 ,
InChIKey CWAPEEAMMSAHDI-BDSZVJCYNA-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)29(18-3-7-22(39)26(43)14-18)31(19)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-/m1/s1
SMILES c1(ccc2c(c1O)[C@H]([C@@H](C(=C2)C(=O)O[C@H](Cc1ccc(c(c1)O)O)C(=O)O)C(=O)O[C@H](Cc1ccc(c(c1)O)O)C(=O)O)c1cc(c(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia yunnanensis Ref.
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