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Details

Stereochemistry ACHIRAL
Molecular Formula C24H26O8
Molecular Weight 442.4584
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-O-DECYLELLAGIC ACID

SMILES

CCCCCCCCCCOC1=C2OC(=O)C3=CC(O)=C(O)C4=C3C2=C(C=C1O)C(=O)O4

InChI

InChIKey=IOLJKBSBRLZDIU-UHFFFAOYSA-N
InChI=1S/C24H26O8/c1-2-3-4-5-6-7-8-9-10-30-20-16(26)12-14-18-17-13(24(29)32-22(18)20)11-15(25)19(27)21(17)31-23(14)28/h11-12,25-27H,2-10H2,1H3

HIDE SMILES / InChI

Molecular Formula C24H26O8
Molecular Weight 442.4584
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:52:06 GMT 2023
Edited
by admin
on Fri Dec 15 17:52:06 GMT 2023
Record UNII
DZ18RB6P6O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-O-DECYLELLAGIC ACID
Common Name English
DECYLELLAGIC ACID, 3-O-
Common Name English
(1)BENZOPYRANO(5,4,3-CDE)(1)BENZOPYRAN-5,10-DIONE, 3-(DECYLOXY)-2,7,8-TRIHYDROXY-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50149099
Created by admin on Fri Dec 15 17:52:06 GMT 2023 , Edited by admin on Fri Dec 15 17:52:06 GMT 2023
PRIMARY
CAS
110007-19-7
Created by admin on Fri Dec 15 17:52:06 GMT 2023 , Edited by admin on Fri Dec 15 17:52:06 GMT 2023
PRIMARY
FDA UNII
DZ18RB6P6O
Created by admin on Fri Dec 15 17:52:06 GMT 2023 , Edited by admin on Fri Dec 15 17:52:06 GMT 2023
PRIMARY
PUBCHEM
5487305
Created by admin on Fri Dec 15 17:52:06 GMT 2023 , Edited by admin on Fri Dec 15 17:52:06 GMT 2023
PRIMARY