input word = C00048540

Metabolite InformationStructural formula
Name Sinuolatin C
(-)-Sinuolatin C
Formula C22H32O6
Mw 392.21988875
CAS RN 1196974-03-4
C_ID C00048540 ,
InChIKey DPYYZDRCUBZMRY-ZTGTXSEBNA-N
InChICode InChI=1S/C22H32O6/c1-11-13-9-21(17(11)25)15(8-14(13)24)20-7-5-6-19(3,4)16(20)18(28-12(2)23)22(21,26)27-10-20/h13-18,24-26H,1,5-10H2,2-4H3/t13-,14-,15+,16-,17-,18+,20-,21+,22-/m1/s1
SMILES C1[C@]23[C@@H](C(CC1)(C)C)[C@@H]([C@]([C@@]14[C@H]2C[C@H]([C@@H](C(=C)[C@H]1O)C4)O)(OC3)O)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon sinuolata Ref.
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