Account Ethanaminium, 2-[[hydroxy[[(2S,3R,4E)-3-hydroxy-2-[[12-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-1-oxododecyl]amino]-4-octadecen-1-yl]oxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt
- Catalog No. :
- ACMNUY523
- CAS No. :
- 254117-01-6
- Molecular Formula :
- C41H73N6O9P
- Molecular Weight :
- 825.04
IUPAC Name:(2S,3R,E)-3-hydroxy-2-(12-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)dodecanamido)octadec-4-en-1-yl (2-(trimethylammonio)ethyl) phosphate
![Ethanaminium, 2-[[hydroxy[[(2S,3R,4E)-3-hydroxy-2-[[12-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-1-oxododecyl]amino]-4-octadecen-1-yl]oxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Ethanaminium, 2-[[hydroxy[[(2S,3R,4E)-3-hydroxy-2-[[12-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-1-oxododecyl]amino]-4-octadecen-1-yl]oxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt |
|---|---|
| IUPAC Name | (2S,3R,E)-3-hydroxy-2-(12-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)dodecanamido)octadec-4-en-1-yl (2-(trimethylammonio)ethyl) phosphate |
| Molecular Formula | C41H73N6O9P |
| Molecular Weight | 825.04 |
| SMILES | O=P(OCC[N+](C)(C)C)([O-])OC[C@H](NC(CCCCCCCCCCCNC1=CC=C([N+]([O-])=O)C2=NON=C21)=O)[C@H](O)/C=C/CCCCCCCCCCCCC |
| InChI Key | FCQMKLRMKNYONQ-YPGNEAGUSA-N |
| Synonym | N-(NBD-AMINOLAUROYL)SPHINGOMYELIN;N-DODECANOYL-NBD-SPHINGOSYLPHOSPHORYLCHOLINE;N-(12-[(7-NITRO-2-1,3-BENZOXADIAZOL-4-YL)AMINO]DODECANOYL)-SPHINGOSINE-1-PHOSPHOCHOLINE;N-C12-NBD-SPHINGOSYLPHOSPHORYLCHOLINE;FLUORESCENT SPHINGOMYELIN;C12 NBD-SPHINGOMYELIN;C12-NBD-SPHINGOMYELIN, FLUORESCENT;N-[12-[(7-NITRO-2-1,3-BENZOXADIAZOL-4-YL)AMINO]DODECANOYL]-SPHINGOSINE-1-PHOSPHOCHOLINE;C12-NBD SPHINGOMYELIN |
| CAS No. | 254117-01-6 |
| PubChem CID | 71312179 |
Synthetic Route by SureRoute
2. ACMNUY523 Molecular Building Block Synthetic Route
6-((N-(7-nitrobenz-2-oxa-1,3-diazol-4-yl)amino)-hexanoyl)sphingosylphosphocholine
Hexanamide, N-[(1S,2R,3E)-2-hydroxy-1-(hydroxymethyl)-3-heptadecen-1-yl]-6-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-
N-((2S,3R,E)-1,3-Dihydroxy-18-((7-nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)octadec-4-en-2-yl)stearamide