input word = C00062771

Metabolite InformationStructural formula
Name (3R,5S)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-3,5-heptanediol, 3-acetate
Formula C23H30O7
Mw 418.19915331
CAS RN 718638-70-1
C_ID C00062771
InChIKey AVAOBMODCJNIGA-RBUKOAKNSA-N
InChICode InChI=1S/C23H30O7/c1-15(24)30-19(9-5-17-7-11-21(27)23(13-17)29-3)14-18(25)8-4-16-6-10-20(26)22(12-16)28-2/h6-7,10-13,18-19,25-27H,4-5,8-9,14H2,1-3H3/t18-,19+/m0/s1
SMILES COc1cc(CCC(O)CC(CCc2ccc(O)c(OC)c2)OC(C)=O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZingiberaceaeZingiber officinale Ref.
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