U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry MIXED
Molecular Formula C12H12O5
Molecular Weight 236.2207
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PMK METHYL GLYCIDATE

SMILES

COC(=O)C1(C)OC1C2=CC3=C(OCO3)C=C2

InChI

InChIKey=NEWFBAYQRLTJTP-UHFFFAOYSA-N
InChI=1S/C12H12O5/c1-12(11(13)14-2)10(17-12)7-3-4-8-9(5-7)16-6-15-8/h3-5,10H,6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H12O5
Molecular Weight 236.2207
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:45:41 UTC 2023
Edited
by admin
on Sat Dec 16 15:45:41 UTC 2023
Record UNII
JJU4XT142X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PMK METHYL GLYCIDATE
Common Name English
PMK METHYL GLYCIDATE [NFLIS-DRUG]
Common Name English
3-(1,3-BENZODIOXOL-5-YL)-2-METHYL-2-OXIRANECARBOXYLIC ACID, METHYL ESTER
Systematic Name English
3,4-MDP-2-P METHYL GLYCIDATE
Common Name English
PMK GLYCIDATE
Common Name English
GLYCIDIC ACID, 3-(3,4-(METHYLENEDIOXY)PHENYL)-2-METHYL-, METHYL ESTER
Systematic Name English
2-OXIRANECARBOXYLIC ACID, 3-(1,3-BENZODIOXOL-5-YL)-2-METHYL-, METHYL ESTER
Systematic Name English
METHYL 3-(2H-1,3-BENZODIOXOL-5-YL)-2-METHYLOXIRANE-2-CARBOXYLATE
Systematic Name English
Classification Tree Code System Code
DEA NO. 8535
Created by admin on Sat Dec 16 15:45:42 UTC 2023 , Edited by admin on Sat Dec 16 15:45:42 UTC 2023
Code System Code Type Description
FDA UNII
JJU4XT142X
Created by admin on Sat Dec 16 15:45:42 UTC 2023 , Edited by admin on Sat Dec 16 15:45:42 UTC 2023
PRIMARY
CAS
13605-48-6
Created by admin on Sat Dec 16 15:45:42 UTC 2023 , Edited by admin on Sat Dec 16 15:45:42 UTC 2023
PRIMARY
PUBCHEM
91600766
Created by admin on Sat Dec 16 15:45:42 UTC 2023 , Edited by admin on Sat Dec 16 15:45:42 UTC 2023
PRIMARY
Related Record Type Details
PARENT->PRECURSOR
PARENT->PRECURSOR
PARENT->PRECURSOR