input word = C00060478

Metabolite InformationStructural formula
Name [(1S,4aR,4bS,7S,10aR)-7-Ethenyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydro-1,4a,7-trimethyl-1-phenanthrenyl]methyl alpha-L-arabinofuranoside, 5-acetate
Formula C27H42O6
Mw 462.29813907
CAS RN 1808014-12-1
C_ID C00060478
InChIKey HBZZAIWGPLKKMJ-OYMKYVHCSA-N
InChICode InChI=1S/C27H42O6/c1-6-25(3)13-10-19-18(14-25)8-9-21-26(4,11-7-12-27(19,21)5)16-32-24-23(30)22(29)20(33-24)15-31-17(2)28/h6,8,19-24,29-30H,1,7,9-16H2,2-5H3/t19-,20-,21-,22-,23+,24+,25-,26+,27+/m0/s1
SMILES C=CC1(C)CCC2C(=CCC3C(C)(COC4OC(COC(C)=O)C(O)C4O)CCCC23C)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlismataceaeSagittaria latifolia Ref.
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