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Details

Stereochemistry RACEMIC
Molecular Formula C18H20O5
Molecular Weight 316.3484
Optical Activity ( + / - )
Defined Stereocenters 4 / 4
E/Z Centers 1
Charge 0

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

SMILES

C[C@H]1CCCC2=C1[C@H]3OC(=O)\C(=C\O[C@@H]4OC(=O)C(C)=C4)[C@H]3C2

InChI

InChIKey=KHSREFIWULNDAB-YCUBLIQYSA-N
InChI=1S/C18H20O5/c1-9-4-3-5-11-7-12-13(18(20)23-16(12)15(9)11)8-21-14-6-10(2)17(19)22-14/h6,8-9,12,14,16H,3-5,7H2,1-2H3/b13-8+/t9-,12+,14+,16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C18H20O5
Molecular Weight 316.3484
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 04:59:31 GMT 2025
Edited
by admin
on Wed Apr 02 04:59:31 GMT 2025
Record UNII
Z0IL7QT5MJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(±)-SORGOLACTONE
Preferred Name English
SORGOLACTONE, (±)-
Systematic Name English
2H-INDENO(1,2-B)FURAN-2-ONE, 3-((((2R)-2,5-DIHYDRO-4-METHYL-5-OXO-2-FURANYL)OXY)METHYLENE)-3,3A,4,5,6,7,8,8B-OCTAHYDRO-8-METHYL-, (3E,3AR,8S,8BS)-REL-
Systematic Name English
Code System Code Type Description
FDA UNII
Z0IL7QT5MJ
Created by admin on Wed Apr 02 04:59:31 GMT 2025 , Edited by admin on Wed Apr 02 04:59:31 GMT 2025
PRIMARY
CAS
188970-36-7
Created by admin on Wed Apr 02 04:59:31 GMT 2025 , Edited by admin on Wed Apr 02 04:59:31 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE