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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H34O5
Molecular Weight 390.5131
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of BLXA4-ME

SMILES

CCCCC[C@@H](O)\C=C\C1=C(/C=C/[C@@H](O)[C@@H](O)CCCC(=O)OC)C=CC=C1

InChI

InChIKey=CHUQDPKHYXGMEB-IQOAYPBESA-N
InChI=1S/C23H34O5/c1-3-4-5-11-20(24)16-14-18-9-6-7-10-19(18)15-17-22(26)21(25)12-8-13-23(27)28-2/h6-7,9-10,14-17,20-22,24-26H,3-5,8,11-13H2,1-2H3/b16-14+,17-15+/t20-,21+,22-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
BLXA4-ME
Common Name English
BLXA4-METHYL ESTER
Common Name English
7-OCTENOIC ACID, 5,6-DIHYDROXY-8-(2-((1E,3R)-3-HYDROXY-1-OCTEN-1-YL)PHENYL)-, METHYL ESTER, (5S,6R,7E)-
Systematic Name English
BLXA-4-ME
Common Name English
BENZO-LXA4-METHYL ESTER
Common Name English
Code System Code Type Description
CAS
362516-29-8
Created by admin on Sat Dec 16 08:30:17 UTC 2023 , Edited by admin on Sat Dec 16 08:30:17 UTC 2023
PRIMARY
FDA UNII
KA6Q1QB6DB
Created by admin on Sat Dec 16 08:30:17 UTC 2023 , Edited by admin on Sat Dec 16 08:30:17 UTC 2023
PRIMARY
PUBCHEM
10222011
Created by admin on Sat Dec 16 08:30:17 UTC 2023 , Edited by admin on Sat Dec 16 08:30:17 UTC 2023
PRIMARY