input word = C00003481

Metabolite InformationStructural formula
Name Shikodonin
Formula C20H26O6
Mw 362.17293856
CAS RN 66548-00-3
C_ID C00003481 ,
InChIKey BTRYMTRPHJVMRG-YOWNZUJSNA-N
InChICode InChI=1S/C20H26O6/c1-10-11-6-12(21)13-19(9-26-17(24)20(13,7-11)15(10)22)5-3-4-18(2)8-25-16(23)14(18)19/h11-14,16,21,23H,1,3-9H2,2H3/t11-,12-,13+,14-,16+,18+,19+,20+/m1/s1
SMILES C=C1C(=O)[C@]23C[C@H]1C[C@@H](O)[C@H]2[C@@]1(CCC[C@@]2(C)CO[C@H](O)C21)COC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon shikokiana var.occidentalis Ref.
PlantaeLabiataeIsodon shikokianus var. intermedius Ref.
PlantaeLamiaceaeRabdosia shikokiana Ref.
zoom in