input word = C00023369

Metabolite InformationStructural formula
Name Galeopsinolone
Formula C20H28O3
Mw 316.20384476
CAS RN 87440-57-1
C_ID C00023369 ,
InChIKey RSNNYUGKTVPAHT-FIVHGIJGNA-N
InChICode InChI=1S/C20H28O3/c1-5-14-15(11-13-7-10-23-12-13)18(22)20(4)9-6-8-19(2,3)17(20)16(14)21/h7,10,12,16-17,21H,5-6,8-9,11H2,1-4H3/t16-,17-,20+/m1/s1
SMILES C1CC([C@@H]2[C@](C1)(C(=O)C(=C([C@H]2O)CC)Cc1cocc1)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeGaleopsis angustifolia Ref.
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