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Details

Stereochemistry RACEMIC
Molecular Formula C21H24O7
Molecular Weight 388.4111
Optical Activity ( + / - )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Medioresinol, (±)-

SMILES

COC1=CC(=CC=C1O)[C@H]2OC[C@H]3[C@@H]2CO[C@@H]3C4=CC(OC)=C(O)C(OC)=C4

InChI

InChIKey=VJOBNGRIBLNUKN-BMHXQBNDSA-N
InChI=1S/C21H24O7/c1-24-16-6-11(4-5-15(16)22)20-13-9-28-21(14(13)10-27-20)12-7-17(25-2)19(23)18(8-12)26-3/h4-8,13-14,20-23H,9-10H2,1-3H3/t13-,14-,20+,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H24O7
Molecular Weight 388.4111
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:09:04 GMT 2025
Edited
by admin
on Wed Apr 02 17:09:04 GMT 2025
Record UNII
QCA4FQ7DGL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DL-Medioresinol
Preferred Name English
Medioresinol, (±)-
Common Name English
Phenol, 2,6-dimethoxy-4-[tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-1H,3H-furo[3,4-c]furan-1-yl]-, (1?,3a?,4?,6a?)-(±)-
Systematic Name English
Phenol, 2,6-dimethoxy-4-[tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-1H,3H-furo[3,4-c]furan-1-yl]-, (1?,3a?,4?,6a?)-
Systematic Name English
Phenol, 2,6-dimethoxy-4-[(1R,3aS,4R,6aS)-tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-1H,3H-furo[3,4-c]furan-1-yl]-, rel-
Systematic Name English
Code System Code Type Description
FDA UNII
QCA4FQ7DGL
Created by admin on Wed Apr 02 17:09:04 GMT 2025 , Edited by admin on Wed Apr 02 17:09:04 GMT 2025
PRIMARY
CAS
74465-40-0
Created by admin on Wed Apr 02 17:09:04 GMT 2025 , Edited by admin on Wed Apr 02 17:09:04 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE