input word = C00034669

Metabolite InformationStructural formula
Name Salvinorin A
Formula C23H28O8
Mw 432.17841787
CAS RN 83729-01-5
C_ID C00034669 ,
InChIKey OBSYBRPAKCASQB-KDPFQZOCNA-N
InChICode InChI=1S/C23H28O8/c1-12(24)30-16-9-15(20(26)28-4)22(2)7-5-14-21(27)31-17(13-6-8-29-11-13)10-23(14,3)19(22)18(16)25/h6,8,11,14-17,19H,5,7,9-10H2,1-4H3/t14-,15-,16-,17-,19-,22-,23-/m0/s1
SMILES [C@@H]1(C[C@H]([C@]2([C@H](C1=O)[C@@]1([C@@H](CC2)C(=O)O[C@@H](C1)c1cocc1)C)C)C(=O)OC)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia divinorum Ref.
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