input word = C00012132

Metabolite InformationStructural formula
Name [4R-(4R*,6S*,7R*,10R*)]-4,6-bis(Acetyloxy)-3-[(acetyloxy)methyl]-5,6,7,8,9,10-hexahydro-7-hydroxy-6,10-dimethyl-7,10-epoxycyclodeca[b]furan-2(4H)-one
Formula C21H26O10
Mw 438.15259705
CAS RN 72748-29-9
C_ID C00012132 ,
InChIKey SLFXSRCDJNCMKH-OVCLIPMQNA-N
InChICode InChI=1S/C21H26O10/c1-11(22)27-10-14-17-15(29-18(14)25)8-19(4)6-7-21(26,31-19)20(5,30-13(3)24)9-16(17)28-12(2)23/h8,16,26H,6-7,9-10H2,1-5H3/b15-8+/t16-,19-,20+,21+/m0/s1
SMILES CC(=O)OCC1=C2/C(=CC3(C)CCC(O)(O3)C(C)(OC(C)=O)CC2OC(C)=O)OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeStokesia laevis Ref.
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