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

Details

Stereochemistry RACEMIC
Molecular Formula C19H38O5
Molecular Weight 346.502
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHLOIONOLIC ACID METHYL ESTER

SMILES

COC(=O)CCCCCCC[C@@H](O)[C@H](O)CCCCCCCCO

InChI

InChIKey=FAQXXHHGYOIFAQ-QZTJIDSGSA-N
InChI=1S/C19H38O5/c1-24-19(23)15-11-7-4-6-10-14-18(22)17(21)13-9-5-2-3-8-12-16-20/h17-18,20-22H,2-16H2,1H3/t17-,18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H38O5
Molecular Weight 346.502
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:37:05 GMT 2023
Edited
by admin
on Sat Dec 16 09:37:05 GMT 2023
Record UNII
Z05D595OAY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHLOIONOLIC ACID METHYL ESTER
MI  
Common Name English
PHLOIONOLIC ACID METHYL ESTER [MI]
Common Name English
OCTADECANOIC ACID, 9,10,18-TRIHYDROXY-, METHYL ESTER, THREO-
Common Name English
(9R,10R)-REL-9,10,18-TRIHYDROXYOCTADECANOIC ACID, METHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
Z05D595OAY
Created by admin on Sat Dec 16 09:37:05 GMT 2023 , Edited by admin on Sat Dec 16 09:37:05 GMT 2023
PRIMARY
CAS
14918-20-8
Created by admin on Sat Dec 16 09:37:05 GMT 2023 , Edited by admin on Sat Dec 16 09:37:05 GMT 2023
PRIMARY
MERCK INDEX
m400
Created by admin on Sat Dec 16 09:37:05 GMT 2023 , Edited by admin on Sat Dec 16 09:37:05 GMT 2023
PRIMARY Merck Index
PUBCHEM
90479066
Created by admin on Sat Dec 16 09:37:05 GMT 2023 , Edited by admin on Sat Dec 16 09:37:05 GMT 2023
PRIMARY