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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H34O3
Molecular Weight 286.4501
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESP-31015

SMILES

CC(C)(CO)CCCCC(=O)CCCCC(C)(C)CO

InChI

InChIKey=FGTDNJHSEFINNG-UHFFFAOYSA-N
InChI=1S/C17H34O3/c1-16(2,13-18)11-7-5-9-15(20)10-6-8-12-17(3,4)14-19/h18-19H,5-14H2,1-4H3

HIDE SMILES / InChI

Approval Year

Name Type Language
ETC-1001
Preferred Name English
ESP-31015
Code English
ETC1001
Code English
7-TRIDECANONE, 1,13-DIHYDROXY-2,2,12,12-TETRAMETHYL-
Systematic Name English
ESP31015
Code English
1,13-DIHYDROXY-2,2,12,12-TETRAMETHYL-TRIDECAN-7-ONE
Systematic Name English
Code System Code Type Description
CAS
413624-55-2
Created by admin on Tue Apr 01 16:27:42 GMT 2025 , Edited by admin on Tue Apr 01 16:27:42 GMT 2025
PRIMARY
PUBCHEM
9925917
Created by admin on Tue Apr 01 16:27:42 GMT 2025 , Edited by admin on Tue Apr 01 16:27:42 GMT 2025
PRIMARY
DRUG BANK
DB05866
Created by admin on Tue Apr 01 16:27:42 GMT 2025 , Edited by admin on Tue Apr 01 16:27:42 GMT 2025
PRIMARY
FDA UNII
G6QP69A673
Created by admin on Tue Apr 01 16:27:42 GMT 2025 , Edited by admin on Tue Apr 01 16:27:42 GMT 2025
PRIMARY