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Details

Stereochemistry ACHIRAL
Molecular Formula C21H37NO2
Molecular Weight 335.524
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DES(OCTYL)DECYL FINGOLIMOD

SMILES

CCCCCCCCCCC1=CC=C(CCC(N)(CO)CO)C=C1

InChI

InChIKey=JXAKCYOWWFCUAR-UHFFFAOYSA-N
InChI=1S/C21H37NO2/c1-2-3-4-5-6-7-8-9-10-19-11-13-20(14-12-19)15-16-21(22,17-23)18-24/h11-14,23-24H,2-10,15-18,22H2,1H3

HIDE SMILES / InChI

Molecular Formula C21H37NO2
Molecular Weight 335.524
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 Sat Dec 16 18:42:54 UTC 2023
Edited
by admin
on Sat Dec 16 18:42:54 UTC 2023
Record UNII
O89SX9O9LL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DES(OCTYL)DECYL FINGOLIMOD
Common Name English
2-AMINO-2-(2-(4-DECYLPHENYL)ETHYL)-1,3-PROPANEDIOL
Systematic Name English
FINGOLIMOD DECYL HOMOLOG
Common Name English
FINGOLIMOD DECYL HOMOLOG [USP IMPURITY]
Common Name English
2-AMINO-2-(4-DECYLPHENETHYL)PROPANE-1,3-DIOL
Systematic Name English
2-amino-2-[2-(4-decylphenyl)ethyl]propane-1,3-diol
Systematic Name English
FINGOLIMOD HYDROCHLORIDE IMPURITY D [EP IMPURITY]
Common Name English
1,3-PROPANEDIOL, 2-AMINO-2-(2-(4-DECYLPHENYL)ETHYL)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40442283
Created by admin on Sat Dec 16 18:42:54 UTC 2023 , Edited by admin on Sat Dec 16 18:42:54 UTC 2023
PRIMARY
CAS
780729-32-0
Created by admin on Sat Dec 16 18:42:54 UTC 2023 , Edited by admin on Sat Dec 16 18:42:54 UTC 2023
PRIMARY
FDA UNII
O89SX9O9LL
Created by admin on Sat Dec 16 18:42:54 UTC 2023 , Edited by admin on Sat Dec 16 18:42:54 UTC 2023
PRIMARY
PUBCHEM
10595435
Created by admin on Sat Dec 16 18:42:54 UTC 2023 , Edited by admin on Sat Dec 16 18:42:54 UTC 2023
PRIMARY
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