input word = C00040215

Metabolite InformationStructural formula
Name Sarcohydroquinone sulfate A
Formula C36H54O5S
Mw 598.36919556
CAS RN 144861-49-4
C_ID C00040215 ,
InChIKey SALJZRCSOZEVES-LAAQXVIISA-N
InChICode InChI=1S/C36H54O5S/c1-28(2)13-8-14-29(3)15-9-16-30(4)17-10-18-31(5)19-11-20-32(6)21-12-22-33(7)23-24-34-27-35(25-26-36(34)37)41-42(38,39)40/h13,15,17,19,21,23,25-27,37H,8-12,14,16,18,20,22,24H2,1-7H3,(H,38,39,40)/b29-15+,30-17+,31-19+,32-21+,33-23+
SMILES c1cc(c(cc1OS(=O)(=O)O)C/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)\C)\C)\C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Sarcotragus spinulosus Ref.
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