input word = C00062770

Metabolite InformationStructural formula
Name (3S,5S)-1,7-Bis(4-hydroxy-3-methoxyphenyl)-3,5-heptanediol, 3,5-diacetate
Formula C25H32O8
Mw 460.209718
CAS RN 718638-64-3
C_ID C00062770
InChIKey DRDZHMFYPWLHJH-SFTDATJTSA-N
InChICode InChI=1S/C25H32O8/c1-16(26)32-20(9-5-18-7-11-22(28)24(13-18)30-3)15-21(33-17(2)27)10-6-19-8-12-23(29)25(14-19)31-4/h7-8,11-14,20-21,28-29H,5-6,9-10,15H2,1-4H3/t20-,21-/m0/s1
SMILES COc1cc(CCC(CC(CCc2ccc(O)c(OC)c2)OC(C)=O)OC(C)=O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZingiberaceaeZingiber officinale Ref.
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OrganismZingiber officinale
Referencehttps://doi.org/10.1021/acs.jafc.8b03600