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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H20O7
Molecular Weight 384.3793
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SESANGOLIN

SMILES

COC1=C(C=C2OCOC2=C1)[C@H]3OC[C@H]4[C@@H]3CO[C@@H]4C5=CC=C6OCOC6=C5

InChI

InChIKey=CXRGUJLWMNJJDZ-BMHXQBNDSA-N
InChI=1S/C21H20O7/c1-22-16-6-19-18(27-10-28-19)5-12(16)21-14-8-23-20(13(14)7-24-21)11-2-3-15-17(4-11)26-9-25-15/h2-6,13-14,20-21H,7-10H2,1H3/t13-,14-,20+,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H20O7
Molecular Weight 384.3793
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 12:08:49 GMT 2025
Edited
by admin
on Wed Apr 02 12:08:49 GMT 2025
Record UNII
YR6394MMJ2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BENZODIOXOLE, 5-((1S,3AR,4S,6AR)-4-(1,3-BENZODIOXOL-5-YL)TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1-YL)-6-METHOXY-
Preferred Name English
SESANGOLIN
Common Name English
5-((1S,3AR,4S,6AR)-4-(1,3-BENZODIOXOL-5-YL)TETRAHYDRO-1H,3H-FURO(3,4-C)FURAN-1-YL)-6-METHOXY-1,3-BENZODIOXOLE
Systematic Name English
1H,3H-FURO(3,4-C)FURAN, TETRAHYDRO-1-(2-METHOXY-4,5-(METHYLENEDIOXY)PHENYL)-4-(3,4-(METHYLENEDIOXY)PHENYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
YR6394MMJ2
Created by admin on Wed Apr 02 12:08:49 GMT 2025 , Edited by admin on Wed Apr 02 12:08:49 GMT 2025
PRIMARY
CAS
100268-57-3
Created by admin on Wed Apr 02 12:08:49 GMT 2025 , Edited by admin on Wed Apr 02 12:08:49 GMT 2025
PRIMARY
PUBCHEM
12315485
Created by admin on Wed Apr 02 12:08:49 GMT 2025 , Edited by admin on Wed Apr 02 12:08:49 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
Natural antioxidant found in cultivated sesame oil.