input word = C00051712

Metabolite InformationStructural formula
Name o-Methylshikoccin
Formula C23H32O5
Mw 388.22497413
CAS RN 83159-26-6
C_ID C00051712
InChIKey NVBWVGPWRHPQET-UHFFFAOYNA-N
InChICode InChI=1S/C23H32O5/c1-13-15-7-8-19(25)23(5)10-9-20(28-14(2)24)22(3,4)18(23)12-17(27-6)16(11-15)21(13)26/h11,15,17-18,20H,1,7-10,12H2,2-6H3
SMILES C=C1C(=O)C2=CC1CCC(=O)C1(C)CCC(OC(C)=O)C(C)(C)C1C(OC)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon shikokiana var.occidentalis Ref.
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OrganismIsodon shikokiana var.occidentalis
ReferenceSun, et al., Diterpenoids from Isodon Species, Science Press, Beijing, (2001)