**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

Sphingomyelin (homo sapiens)

Properties Image MNX_ID MNXM5930 reference biggM:sphmyln_hs formula C28H60N3O6P global charge 2 mol weight 565.777 InChIKey CSURBFNJGNBURS-AHHYHCMUSA-P InChI InChI=1S/C28H58N3O6P/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27(32)26(29-28(33)24-31(5,6)7)25-37-38(34,35)36-23-22-30(2,3)4/h20-21,26-27,32H,8-19,22-25H2,1-7H3/p+2/b21-20+/t26-,27+/m0/s1 SMILES CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)OCC[N+](C)(C)C)NC(=O)C[N+](C)(C)C MNX internals InChI (mnx) InChI=1/C28H58N3O6P/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27(32)26(29-28(33)24-31(5,6)7)25-37-38(34,35)36-23-22-30(2,3)4/h20-21,26-27,32H,8-19,22-25H2,1-7H3/b21-20+/t26-,27+/m0/s1 SMILES (mnx) [CH3:1][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19]/[CH:20]=[CH:21]/[C@H:27]([C@H:26]([CH2:25][O:37][P:38](=[O:34])([O-:35])[O:36][CH2:23][CH2:22][N+:30]([CH3:2])([CH3:3])[CH3:4])[N:29]=[C:28]([CH2:24][N+:31]([CH3:5])([CH3:6])[CH3:7])[O-:33])[OH:32]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 16 in models (compartimentalized) 24

Similar chemical compounds in external resources

Identifier	Description
bigg.metabolite:sphmyln_hs biggM:sphmyln_hs CSURBFNJGNBURS-AHHYHCMUSA-P	Sphingomyelin (homo sapiens)
vmhM:sphmyln_hs vmhM:sphmyln_hs vmhmetabolite:sphmyln_hs vmhmetabolite:sphmyln_hs CSURBFNJGNBURS-AHHYHCMUSA-P	sphingomyelin betaine 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol
biggM:M_sphmyln_hs vmhM:M_sphmyln_hs	secondary/obsolete/fantasy identifier