input word = C00059684

Metabolite InformationStructural formula
Name (5R)-5-Acetoxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptan-3-one
Formula C23H28O7
Mw 416.18350325
CAS RN 1339934-22-3
C_ID C00059684
InChIKey CDIQAHPGTJXRRX-LJQANCHMSA-N
InChICode InChI=1S/C23H28O7/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/h6-7,10-13,19,26-27H,4-5,8-9,14H2,1-3H3/t19-/m1/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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OrganismZingiber officinale
Referencehttps://doi.org/10.1007/s00217-018-3188-z

https://doi.org/10.1021/acs.jafc.8b03600