input word = C00047216

Metabolite InformationStructural formula
Name Divinatorin D
(-)-Divinatorin D
Formula C23H32O6
Mw 404.21988875
CAS RN 866622-52-8
C_ID C00047216 ,
InChIKey WVLBBIUEFLDDRO-ONGVHUSNNA-N
InChICode InChI=1S/C23H32O6/c1-15(24)29-14-17-8-11-23(3)18(21(26)27-4)5-6-19(25)20(23)22(17,2)10-7-16-9-12-28-13-16/h5,9,12-13,17,19-20,25H,6-8,10-11,14H2,1-4H3/t17-,19-,20+,22-,23-/m0/s1
SMILES COC(=O)C1=CC[C@H](O)[C@@H]2[C@@](C)(CCc3ccoc3)[C@H](COC(C)=O)CC[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia divinorum Ref.
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