input word = C00035425

Metabolite InformationStructural formula
Name Velutine C
Formula C20H28O5
Mw 348.193674
CAS RN 858341-33-0
C_ID C00035425 ,
InChIKey FAVVSWILBWUORT-NSYOMAHZNA-N
InChICode InChI=1S/C20H28O5/c1-12-11-14-15-18(2,17(22)25-14)7-4-8-19(15,3)20(12,23)9-5-13-6-10-24-16(13)21/h6,12,14-15,23H,4-5,7-11H2,1-3H3/t12-,14+,15-,18-,19-,20+/m0/s1
SMILES C[C@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@@](C)([C@@H]23)[C@@]1(O)CCC1=CCOC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeMarrubium velutinum Ref.
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