input word = C00060717

Metabolite InformationStructural formula
Name [1S-(1alpha,3beta,4alpha,4abeta,5beta,6beta,8beta,11alpha,12beta,12aalpha)]-1,2,3,4a,5,7,8,11,12,12a-Decahydro-9,12a,13,13-tetramethyl-Spiro[6,10-methanobenzocyclodecene-4(6H),2'-oxirane]-1,3,5,6,8,11,12-heptol, 1,5,11,12-tetraacetate
Formula C28H40O12
Mw 568.25197674
CAS RN 204838-40-4
C_ID C00060717
InChIKey PDVLDHHFZVPZOY-HIRGMTDPSA-N
InChICode InChI=1S/C28H40O12/c1-12-17(33)10-28(35)24(40-16(5)32)22-26(8,19(37-13(2)29)9-18(34)27(22)11-36-27)23(39-15(4)31)21(38-14(3)30)20(12)25(28,6)7/h17-19,21-24,33-35H,9-11H2,1-8H3/t17-,18-,19-,21+,22-,23-,24-,26+,27+,28+/m0/s1
SMILES CC(=O)OC1C2=C(C)C(O)CC(O)(C(OC(C)=O)C3C4(CO4)C(O)CC(OC(C)=O)C3(C)C1OC(C)=O)C2(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus yunnanensis Ref.
zoom in