Chemical Component Summary | |
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Name | sphingomyelin |
Formula | C47 H94 N2 O6 P |
Molecular Weight | 814.233 |
Type | NON-POLYMER |
Isomeric SMILES | CCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)([OH-])OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC)O |
InChI | InChI=1S/C47H93N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-47(51)48-45(44-55-56(52,53)54-43-42-49(3,4)5)46(50)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2/h20-21,38,40,45-46,50,52H,6-19,22-37,39,41-44H2,1-5H3/q-1/p+1/b21-20-,40-38+/t45-,46+/m0/s1 |
InChIKey | NHYQHBPEJLFFSO-QYKFWSDSSA-O |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 150 |
Chiral Atom Count | 2 |
Bond Count | 149 |
Aromatic Bond Count | 0 |