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

Details

Stereochemistry RACEMIC
Molecular Formula C19H26O3
Molecular Weight 302.4079
Optical Activity ( + / - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLOPROPANECARBOXYLIC ACID, 2,2-DIMETHYL-3-(2-METHYLPROPENYL)-, ESTER WITH 2-ALLYL-4-HYDROXY-3-METHYL-2-CYCLOPENTEN-1-ONE, TRANS-(±)-

SMILES

CC(C)=C[C@@H]1[C@@H](C(=O)O[C@H]2CC(=O)C(CC=C)=C2C)C1(C)C

InChI

InChIKey=ZCVAOQKBXKSDMS-PVAVHDDUSA-N
InChI=1S/C19H26O3/c1-7-8-13-12(4)16(10-15(13)20)22-18(21)17-14(9-11(2)3)19(17,5)6/h7,9,14,16-17H,1,8,10H2,2-6H3/t14-,16+,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H26O3
Molecular Weight 302.4079
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:00:15 GMT 2023
Edited
by admin
on Sat Dec 16 09:00:15 GMT 2023
Record UNII
Y8J603E78R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYCLOPROPANECARBOXYLIC ACID, 2,2-DIMETHYL-3-(2-METHYLPROPENYL)-, ESTER WITH 2-ALLYL-4-HYDROXY-3-METHYL-2-CYCLOPENTEN-1-ONE, TRANS-(±)-
Common Name English
.ALPHA.-DL-TRANS-ALLETHRIN
Common Name English
ALLETHRIN, DL-TRANS-
Common Name English
Code System Code Type Description
CAS
482370-76-3
Created by admin on Sat Dec 16 09:00:15 GMT 2023 , Edited by admin on Sat Dec 16 09:00:15 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
CAS
3972-20-1
Created by admin on Sat Dec 16 09:00:15 GMT 2023 , Edited by admin on Sat Dec 16 09:00:15 GMT 2023
PRIMARY
FDA UNII
Y8J603E78R
Created by admin on Sat Dec 16 09:00:15 GMT 2023 , Edited by admin on Sat Dec 16 09:00:15 GMT 2023
PRIMARY
PUBCHEM
62829
Created by admin on Sat Dec 16 09:00:15 GMT 2023 , Edited by admin on Sat Dec 16 09:00:15 GMT 2023
PRIMARY