input word = C00060772

Metabolite InformationStructural formula
Name (1S,3S,4aR,5R,6R,8S,11R,12R,12aS)-1,2,3,4,4a,5,6,7,8,11,12,12a-Dodecahydro-9,12a,13,13-tetramethyl-4-methylene-6,10-methanobenzocyclodecene-1,3,5,8,11,12-hexol, 1,5,11,12-tetraacetate
Formula C28H40O10
Mw 536.2621475
CAS RN 211105-39-4
C_ID C00060772
InChIKey FUBMOVYEQAHKMA-WDKHEYHYSA-N
InChICode InChI=1S/C28H40O10/c1-12-19(33)10-18-24(36-15(4)30)23-13(2)20(34)11-21(35-14(3)29)28(23,9)26(38-17(6)32)25(37-16(5)31)22(12)27(18,7)8/h18-21,23-26,33-34H,2,10-11H2,1,3-9H3/t18-,19-,20-,21-,23-,24+,25+,26-,28+/m0/s1
SMILES C=C1C(O)CC(OC(C)=O)C2(C)C(OC(C)=O)C(OC(C)=O)C3=C(C)C(O)CC(C(OC(C)=O)C12)C3(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTaxaceaeTaxus cuspidata Ref.
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OrganismTaxus cuspidata
Referencehttps://doi.org/10.1016/S0960-894X(98)00262-5