Structural formula of N-Docosanoyl-D-erythro-sphingosylphosphorylcholine

N-Docosanoyl-D-erythro-sphingosylphosphorylcholine

Product number: 56-1532
CAS number: 94359-12-3
Synonyms: 3,5-Dioxa-8-aza-4-phosphatriacontan-1-aminium, 4-hydroxy-7-(1-hydroxy-2-hexadecenyl)-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, [R-[R*,S*-(E)]]-, 3,5-Dioxa-8-aza-4-phosphatriacontan-1-aminium, 4-hydroxy-7-[(1R,2E)-1-hydroxy-2-hexadecenyl]-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, (7S)-, Sphingomyelin (d18:1 C22:0)

Identifiers

CAS Index Name: 3,5-Dioxa-8-aza-4-phosphatriacontan-1-aminium, 4-hydroxy-7-[(1R,2E)-1-hydroxy-2-hexadecen-1-yl]-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, (7S)-
Molecular formula: C45H91N2O6P
Molecular weight: 787.19
Smiles: O=C(NC(COP(=O)([O-])OCC[N+](C)(C)C)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCC
Isomeric Smiles: C(NC(CCCCCCCCCCCCCCCCCCCCC)=O)(COP(OCC[N+](C)(C)C)(=O)[O-])C(C=CCCCCCCCCCCCCC)O
InChI: InChI=1S/C45H91N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-45(49)46-43(42-53-54(50,51)52-41-40-47(3,4)5)44(48)38-36-34-32-30-28-26-19-17-15-13-11-9-7-2/h36,38,43-44,48H,6-35,37,39-42H2,1-5H3,(H-,46,49,50,51)/b38-36+/t43-,44+/m0/s1
InChIKey: InChIKey=FJJANLYCZUNFSE-TWKUQIQBSA-N

Product information

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

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56-1532-35N-Docosanoyl-D-erythro-sphingosylphosphorylcholine - 500 ug395.00 €