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Details

Stereochemistry RACEMIC
Molecular Formula C10H16O4
Molecular Weight 200.2316
Optical Activity ( + / - )
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PRELOG-DJERASSI LACTONE, (±)-

SMILES

C[C@@H]([C@@H]1OC(=O)[C@@H](C)C[C@H]1C)C(O)=O

InChI

InChIKey=BPPNRVIGLJVOCW-VGRMVHKJSA-N
InChI=1S/C10H16O4/c1-5-4-6(2)10(13)14-8(5)7(3)9(11)12/h5-8H,4H2,1-3H3,(H,11,12)/t5-,6+,7+,8-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
PRELOG-DJERASSI LACTONE, (±)-
Common Name English
(±)-PRELOG-DJERASSI LACTONE
Preferred Name English
2H-PYRAN-2-ACETIC ACID, TETRAHYDRO-.ALPHA.,3,5-TRIMETHYL-6-OXO-, (2.ALPHA.(S*),3.BETA.,5.BETA.)-
Systematic Name English
2H-PYRAN-2-ACETIC ACID, TETRAHYDRO-.ALPHA.,3,5-TRIMETHYL-6-OXO-, (.ALPHA.R,2S,3S,5R)-REL-
Systematic Name English
REL-(.ALPHA.R,2S,3S,5R)-TETRAHYDRO-.ALPHA.,3,5-TRIMETHYL-6-OXO-2H-PYRAN-2-ACETIC ACID
Systematic Name English
Code System Code Type Description
CAS
56781-39-6
Created by admin on Wed Apr 02 13:51:11 GMT 2025 , Edited by admin on Wed Apr 02 13:51:11 GMT 2025
PRIMARY
FDA UNII
V4ZF4JZ47A
Created by admin on Wed Apr 02 13:51:11 GMT 2025 , Edited by admin on Wed Apr 02 13:51:11 GMT 2025
PRIMARY