input word = C00039200

Metabolite InformationStructural formula
Name Excisusin C
(-)-Excisusin C
Formula C22H34O5
Mw 378.2406242
CAS RN 935545-94-1
C_ID C00039200 ,
InChIKey CHKPKMQLJUVPLP-VZQIQSCJNA-N
InChICode InChI=1S/C22H34O5/c1-12-14-9-15(24)18-20(3)7-6-17(25)21(4,11-27-13(2)23)16(20)5-8-22(18,10-14)19(12)26/h14-19,24-26H,1,5-11H2,2-4H3/t14-,15-,16+,17-,18+,19-,20-,21+,22-/m1/s1
SMILES C=C1[C@@H]2C[C@@H](O)[C@H]3[C@]4(C)CC[C@@H](O)[C@@](C)(COC(C)=O)[C@H]4CC[C@]3(C2)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon excisus Ref.
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