Isogloboside i-Forssman (d18:1(4E)/20:0)

Properties Image Occurences in reactions MNX_ID MNXM24340 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C72H131N3O28 charge 0 mass 1485.89191 reference slm:000756237 InChIKey LXQHLJFBIKRCMJ-YSIFRJEPSA-N InChI InChI=1S/C72H131N3O28/c1-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-52(84)75-45(46(83)35-33-31-29-27-25-23-18-16-14-12-10-8-6-2)42-94-70-61(91)60(90)64(51(41-80)99-70)100-71-63(93)67(58(88)50(40-79)97-71)103-72-62(92)66(57(87)49(39-78)98-72)102-69-54(74-44(4)82)65(56(86)48(38-77)96-69)101-68-53(73-43(3)81)59(89)55(85)47(37-76)95-68/h33,35,45-51,53-72,76-80,83,85-93H,5-32,34,36-42H2,1-4H3,(H,73,81)(H,74,82)(H,75,84)/b35-33+/t45-,46+,47+,48+,49+,50+,51+,53+,54+,55-,56-,57-,58-,59+,60+,61+,62+,63+,64+,65+,66-,67-,68+,69-,70+,71-,72+/m0/s1 SMILES CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[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]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5NC(C)=O)[C@H]4NC(C)=O)[C@H]3O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCCCC

Parent-child relations graph

Deprecated MNXref IDs graph