input word = C00037253

Metabolite InformationStructural formula
Name Heliotropinone A
Formula C18H22O4
Mw 302.15180919
CAS RN 381723-52-0
C_ID C00037253 ,
InChIKey KUMTUFPJQNENGL-UHFFFAOYNA-N
InChICode InChI=1S/C18H22O4/c1-7-18(4)9-12-11(8-13(18)10(2)3)14(19)16(21-5)17(22-6)15(12)20/h7,13H,1-2,8-9H2,3-6H3/t13-,18-/m1/s1
SMILES C=CC1(C)CC2=C(CC1C(=C)C)C(=O)C(OC)=C(OC)C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeHeliotropium ovalifolium Ref.
zoom in