Compound Summary
Compound Information
EDELFOSINE
Compound Name: | EDELFOSINE |
Compound CID: | 6918215 |
Synonyms: | EDELFOSINE ET-18-OCH3 77286-66-9 (R)-edelfosine UNII-LZ198HY9OE More... |
Iupac Name: | [(2R)-2-methoxy-3-octadecoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate |
InChI: | InChI=1S/C27H58NO6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-32-25-27(31-5)26-34-35(29,30)33-24-22-28(2,3)4/h27H,6-26H2,1-5H3/t27-/m1/s1 |
InChIKey: | MHFRGQHAERHWKZ-HHHXNRCGSA-N |
Canonical Smiles: | CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OC |
Isomeric Smiles: | CCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC |
Molecular Weight: | 523.7 |
Molecular Formula: | C27H58NO6P |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
EDELFOSINE
Molecular Weight: | 523.7 |
Molecular Formula: | C27H58NO6P |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 6 |
Rotatable Bond Count: | 27 |
Heavy Atom Count: | 35 |
Complexity: | 492 |
Synonyms
EDELFOSINE
| EDELFOSINE | EDELFOSINE |
|---|---|
EDELFOSINE |
ET-18-OCH3 |
77286-66-9 |
(R)-edelfosine |
UNII-LZ198HY9OE |
LZ198HY9OE |
CHEBI:78653 |
1-O-Octadecyl-2-O-methyl-sn-glycero-3-phosphocholine |
(2R)-2-methoxy-3-octadecoxypropyl 2-(trimethylazaniumyl)ethyl phosphate |
NCGC00093851-01 |
3,5,9-Trioxa-4-phosphaheptacosan-1-aminium,4-hydroxy-7-methoxy-N,N,N-trimethyl-, inner salt, 4-oxide, (7R)- |
C27H58NO6P |
MFCD00063527 |
1-Octadecyl-2-methyl-sn-glycero-3-phosphocholine |
1-OCTADECYL-2-METHYLGLYCERO-3 PC |
Edelfosine, (R)- |
(+)-(R)-Edelfosine |
2-O-methyl PAF C-18 |
DSSTox_CID_25766 |
DSSTox_RID_81108 |
TLC-ELL-12 |
DSSTox_GSID_45766 |
SCHEMBL436257 |
BML3-F02 |
CHEMBL107514 |
1-O-Octadecyl-2-O-methyl-sn-glycero-3-phosphorylcholine |
BDBM86730 |
DTXSID20922896 |
HMS1361G03 |
HMS1791G03 |
HMS1989G03 |
HMS3261E22 |
HMS3402G03 |
HMS3648P18 |
Tox21_111225 |
Tox21_500430 |
(+)-(R)-ET-18-OMe |
1310AH |
AKOS024457387 |
CCG-204522 |
LP00430 |
SDCCGSBI-0050415.P002 |
(+)-(R)-ET-18-OCH3 |
NCGC00093851-02 |
NCGC00093851-03 |
NCGC00093851-04 |
NCGC00093851-05 |
NCGC00093851-06 |
NCGC00093851-11 |
NCGC00261115-01 |
PC(O-18:0/O-1:0) |
CAS-70641-51-9 |
CAS_77286-66-9 |
3,5,9-Trioxa-4-phosphaheptacosan-1-aminium |
EU-0100430 |
1-Stearyl-2-methyl-sn-glycero-3-phosphocholine |
E 1779 |
ET-18-OCH - CAS 70641-51-9 |
Q27147892 |
1-O-Octadecyl-2-O-methyl-sn-glyceryl-3-phosphorylcholine |
UNII-1Y6SNA8L5S component MHFRGQHAERHWKZ-HHHXNRCGSA-N |
(2R)-2-methoxy-3-(octadecyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate |
(R)-2-Methoxy-3-(octadecyloxy)propyl (2-(trimethylammonio)ethyl) phosphate |
Edelfosine, 1-O-octadecyl-2-O-methyl-sn-glycero-3-phosphocholine, powder |
Edelfosine, 1-O-octadecyl-2-O-methyl-sn-glycero-3-phosphocholine, chloroform |
(7R)-4-Hydroxy-7-methoxy-N,N,N-trimethyl-3,5,9-trioxa-4-phosphaheptacosan-1-aminium-4-oxide |
3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 4-hydroxy-7-methoxy-N,N,N-trimethyl-, inner salt, 4-oxide, (7R)- |
3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 4-hydroxy-7-methoxy-N,N,N-trimethyl-, inner salt, 4-oxide, (R)- |
3,5,9-Trioxa-4-phosphaheptacosan-1-aminium,4-hydroxy-7-methoxy-N,N,N-trimethyl-,inner salt,4-oxide |
Experimental Data
EDELFOSINE
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33 | umol/L | -15 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
EDELFOSINE
Statistics Data
EDELFOSINE
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -15 | 1 | 1 |
Statistics Data Visualization
EDELFOSINE
