input word = C00036101

Metabolite InformationStructural formula
Name Cornutin G
(-)-Cornutin G
Formula C22H28O6
Mw 388.18858863
CAS RN 630102-43-1
C_ID C00036101 ,
InChIKey GWUYEMRBBQPDLU-SSZXCYHRNA-N
InChICode InChI=1S/C22H28O6/c1-12-9-18-22(4)17(21(12,3)10-15(24)14-7-8-26-11-14)6-5-16(27-13(2)23)19(22)20(25)28-18/h7-8,11-12,16-19H,5-6,9-10H2,1-4H3/t12-,16+,17-,18+,19+,21+,22+/m1/s1
SMILES CC(=O)O[C@H]1CC[C@@H]2[C@@](C)(CC(=O)c3ccoc3)[C@H](C)C[C@@H]3OC(=O)[C@H]1[C@]32C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeCornutia grandifolia var.intermedia Ref.
zoom in