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22:1 SM (d18:1/22:1)-[d9]

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Category	Standards
Catalog NO.	BPG-3208
Product Name	22:1 SM (d18:1/22:1)-[d9]
CAS	2342574-51-8
Molecular Formula	C45H80D9N2O6P
Molecular Weight	794.24

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Synonyms	N-erucoyl-D-erythro-sphingosylphosphorylcholine-d9; 22:1 SM (d18:1/22:1)-d9; SM 22:1 (d18:1/22:1)-d9; N-(13Z-docosenoyl)-sphing-4-enine-1-phosphocholine-d9; SM(d18:1/22:1)-d9; SPH(d18:1/22:1(13Z))-d9; SM(d18:1/22:1(13Z))-d9; C22:1 Sphingomyelin-d9; Sphingomyelin (d18:1/22:1(13Z))-d9
IUPAC Name	[(E,2S,3R)-2-[[(Z)-docos-13-enoyl]amino]-3-hydroxyoctadec-4-enyl] 2-[tris(trideuteriomethyl)azaniumyl]ethyl phosphate
Canonical SMILES	CCCCCCCCCCCCCC=CC(C(COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCC=CCCCCCCCC)O
InChI	InChI=1S/C45H89N2O6P/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/h20-21,36,38,43-44,48H,6-19,22-35,37,39-42H2,1-5H3,(H-,46,49,50,51)/b21-20-,38-36+/t43-,44+/m0/s1/i3D3,4D3,5D3
InChIKey	VBFKEZGCUWHGSK-PAFWCHNCSA-N
Purity	>99%
Solubility	Soluble in Chloroform, DCM, Methanol, Water
Related CAS	222403-68-1 (unlabelled)
Shelf Life	1 Year
Storage	Store at -20°C
Exact Mass	793.7
Hygroscopic	No
Light Sensitive	No
Percent Composition	C 68.05%, H 12.44%, N 3.53%, O 12.09%, P 3.90%

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