Structural formula of C12 NBD-Sphingosylphosphorylcholine

C12 NBD-Sphingosylphosphorylcholine

Product number: 39-5050
CAS number: 254117-01-6
Synonyms: 3,5-Dioxa-8-aza-4-phosphaeicosan-1-aminium, 4-hydroxy-7-[(1R,2E)-1-hydroxy-2-hexadecenyl]-N,N,N-trimethyl-20-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]-9-oxo-, inner salt, 4-oxide, (7S)-

Identifiers

CAS Index 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
Molecular formula: C41H73N6O9P
Molecular weight: 825.03
Smiles: O=C(NC(COP(=O)([O-])OCC[N+](C)(C)C)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCNC1=CC=C(C2=NON=C21)N(=O)=O
Isomeric Smiles: N(CCCCCCCCCCCC(NC(COP(OCC[N+](C)(C)C)(=O)[O-])C(C=CCCCCCCCCCCCCC)O)=O)C=1C=2C(C(N(=O)=O)=CC1)=NON2
InChI: InChI=1S/C41H73N6O9P/c1-5-6-7-8-9-10-11-12-13-15-18-21-24-27-38(48)36(34-55-57(52,53)54-33-32-47(2,3)4)43-39(49)28-25-22-19-16-14-17-20-23-26-31-42-35-29-30-37(46(50)51)41-40(35)44-56-45-41/h24,27,29-30,36,38,48H,5-23,25-26,28,31-34H2,1-4H3,(H2-,42,43,45,49,52,53)/b27-24+/t36-,38+/m0/s1
InChIKey: InChIKey=FCQMKLRMKNYONQ-YPGNEAGUSA-N

Product information

Purity: >98%
Storage: Freezer
Supplied as: Neat
Physical state: Solid
Documentation: Certificate of Analysis
MSDS: Ask for MSDS

Shop now

39-5050-39C12 NBD-Sphingosylphosphorylcholine - 100 ug288.00