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

Ganglioside GM1 (homo sapiens)

PropertiesImage
MNX_IDMNXM1103858 Image of MNXM1103858
referencebiggM:gm1_hs
formulaC56H95N3O31*
global charge-1
mol weight 
InChIKey 
InChI 
SMILES[*]C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3NC(C)=O)[C@H](O[C@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O3)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)/C=C/CCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C57H99N3O31/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-30(69)29(58-26(2)66)25-82-53-45(78)43(76)47(35(23-64)85-53)87-55-46(79)51(91-57(56(80)81)19-31(70)37(59-27(3)67)50(90-57)39(72)32(71)20-61)48(36(24-65)86-55)88-52-38(60-28(4)68)49(41(74)34(22-63)83-52)89-54-44(77)42(75)40(73)33(21-62)84-54/h17-18,29-55,61-65,69-79H,5-16,19-25H2,1-4H3,(H,58,66)(H,59,67)(H,60,68)(H,80,81)/b18-17+/t29-,30+,31-,32+,33+,34+,35+,36+,37+,38+,39+,40-,41-,42-,43+,44+,45+,46+,47+,48-,49+,50+,51+,52-,53+,54-,55-,57-/m0/s1/i2+1 Image of MNXM1103858
SMILES (mnx)[CH3:1][13CH2:2][C@@H:3]([CH3:4])[CH:5]([CH3:6])[CH:7]1[CH2:8][C@@:9]([CH2:10][C@H:11]2[C@H:12]([CH3:13])[C@@H:14]([CH2:15][C@H:16]3[C@H:17]([CH3:18])[C@H:19]([CH3:20])[C@@H:21]([CH2:22][CH2:23][CH:24]([CH2:25][C:26]([CH3:27])=[CH2:28])[C@H:29]([CH3:30])[CH:31]=[CH:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45])[CH2:46][C@@H:47]3[CH2:48][CH3:49])[CH2:50][C@H:51]([CH2:52][CH3:53])[C@H:54]2[CH2:55][C@@H:56]2[CH2:57][N:58]([NH:59][NH2:60])[O@:61]([OH:62])[O@:63]([O:64][O@:65]3[O:66][O@@:67]([O:68][OH:69])[O@:70]([OH:71])[O@@:72]([OH:73])[O@:74]3[OH:75])[O@@:76]2[O:77][O:78](=[O:79])[OH:80])([O:81]([OH:82])=[O:83])[O:84][O:85]([OH:86])[O:87]1[O:88][O:89](=[O:90])[OH:91]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)9
in models (compartimentalized) 19
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:gm1_hs
biggM:gm1_hs 		Ganglioside GM1 (homo sapiens)

biggM:M_gm1_hs 		secondary/obsolete/fantasy identifier