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1-Acetoxypinoresinol

Properties

Image

Occurences in reactions

MNX_ID

MNXM32686

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₂H₂₄O₈

charge

mass

416.14712

reference

chebi:582

InChIKey

NATDFORNCKZPCI-FPHUIIFBSA-N

InChI

InChI=1S/C22H24O8/c1-12(23)30-22-11-29-20(13-4-6-16(24)18(8-13)26-2)15(22)10-28-21(22)14-5-7-17(25)19(9-14)27-3/h4-9,15,20-21,24-25H,10-11H2,1-3H3/t15-,20-,21-,22-/m1/s1

SMILES

COc1cc([C@H]2OC[C@]3(OC(C)=O)[C@@H](c4ccc(O)c(OC)c4)OC[C@H]23)ccc1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
seed.compound:cpd07430 seedM:cpd07430 CHEBI:582 chebi:582 kegg.compound:C10544 keggC:C10544	1-Acetoxypinoresinol
hmdb:HMDB0033280	8-Acetoxypinoresinol 1,4-Bis(4-hydroxy-3-methoxyphenyl)-hexahydrofuro[3,4-c]furan-3a-yl acetic acid 1,4-bis(4-hydroxy-3-methoxyphenyl)-hexahydrofuro[3,4-c]furan-3a-yl acetate 1,4-bis(4-hydroxy-3-methoxyphenyl)-tetrahydro-1H-furo[3,4-c]furan-3a-yl acetate 1-Acetoxypinoresinol
CHEBI:172658 chebi:172658	8-Acetoxypinoresinol [3,6-bis(4-hydroxy-3-methoxyphenyl)-3,4,6,6a-tetrahydro-1H-uro[3,4-c]uran-3a-yl] acetate
hmdb:HMDB33280 keggC:M_C10544 seedM:M_cpd07430	secondary/obsolete/fantasy identifier