Mrv0541 07091416292D 108112 0 0 1 0 999 V2000 43.3361 -16.9486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 44.0236 -16.5361 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 44.0236 -15.7661 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 44.7386 -16.9486 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 44.7386 -15.3537 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 43.3361 -15.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 45.4260 -16.5361 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 44.7111 -17.7461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 45.4260 -15.7661 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 46.1410 -16.9486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 46.1410 -15.3537 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 42.6211 -15.7386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 48.9986 -15.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 49.7131 -15.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 48.2843 -15.7661 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 50.4277 -15.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 47.5699 -15.3537 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 51.1421 -15.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 46.8554 -15.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.8565 -15.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 52.5710 -15.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 48.2843 -16.5910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 47.5697 -14.5287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 48.9985 -14.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 48.2841 -14.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 48.2840 -13.2909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 49.7130 -14.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 50.4274 -14.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.1419 -14.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.8565 -14.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 52.5708 -14.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 53.2853 -14.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 53.9997 -14.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 54.7142 -14.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 55.4285 -14.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 55.4285 -13.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 54.7141 -12.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 53.9997 -13.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 53.2853 -12.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 52.5707 -13.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.8564 -12.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.1419 -13.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 42.6216 -17.3611 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 42.6216 -18.1861 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 41.9071 -16.9486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 41.9071 -18.5986 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 41.1927 -17.3611 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 41.1927 -18.1861 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 43.3361 -18.5986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 41.9071 -19.4235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 40.4782 -18.5986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 40.4782 -16.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 39.7638 -17.3611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 39.7638 -19.0111 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 39.7638 -19.8360 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 39.0493 -18.5986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 39.0493 -20.2485 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 38.3348 -19.0111 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 38.3348 -19.8360 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 40.4782 -20.2485 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 39.0493 -21.0735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 37.6204 -20.2485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 37.6204 -18.5986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.9059 -19.0111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 38.3348 -21.4860 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 38.3348 -22.3110 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 37.6204 -21.0735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 37.6204 -22.7234 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 36.9059 -21.4860 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 36.9059 -22.3110 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 39.0493 -22.7235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 37.6204 -23.5484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 36.1914 -22.7234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 36.1914 -21.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.4769 -21.4860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 40.4782 -21.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 40.9045 -21.4363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 39.7637 -21.4860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 43.0389 -19.6996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 43.7534 -20.1121 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 42.3244 -20.1122 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 43.7534 -20.9372 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 42.3244 -20.9371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 43.0388 -21.3496 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 41.5298 -20.3341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 41.1559 -20.7953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 40.9403 -19.7569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 44.4678 -19.6996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 44.4678 -21.3497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 45.1822 -20.9372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 45.8967 -21.3497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 45.1822 -20.1122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 43.0388 -22.1746 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 42.3244 -22.5871 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 42.3244 -23.4120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 41.6098 -23.8245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 41.6099 -22.1746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 43.7533 -22.5872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 42.4007 -21.8089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 52.5711 -16.5911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.8566 -17.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.8567 -17.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.1422 -18.2412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.1423 -19.0662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 50.4278 -19.4788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 50.4278 -20.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 49.7134 -20.7163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 49.7134 -21.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 1 0 0 0 4 7 1 0 0 0 0 4 8 1 1 0 0 0 5 9 1 0 0 0 0 7 10 1 6 0 0 0 9 11 1 1 0 0 0 7 9 1 0 0 0 0 6 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 22 1 1 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 17 23 1 6 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 11 1 0 0 0 0 20 21 1 0 0 0 0 23 25 1 0 0 0 0 25 24 1 0 0 0 0 25 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 44 46 1 0 0 0 0 45 47 1 0 0 0 0 46 48 1 0 0 0 0 47 48 1 0 0 0 0 43 1 1 1 0 0 0 44 49 1 6 0 0 0 46 50 1 1 0 0 0 48 51 1 1 0 0 0 47 52 1 1 0 0 0 53 52 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 55 57 1 0 0 0 0 56 58 1 0 0 0 0 57 59 1 0 0 0 0 58 59 1 0 0 0 0 54 51 1 1 0 0 0 55 60 1 6 0 0 0 57 61 1 1 0 0 0 59 62 1 1 0 0 0 58 63 1 1 0 0 0 64 63 1 0 0 0 0 65 66 1 0 0 0 0 65 67 1 0 0 0 0 66 68 1 0 0 0 0 67 69 1 0 0 0 0 68 70 1 0 0 0 0 69 70 1 0 0 0 0 65 61 1 1 0 0 0 66 71 1 6 0 0 0 68 72 1 1 0 0 0 70 73 1 1 0 0 0 69 74 1 1 0 0 0 75 74 1 0 0 0 0 60 76 1 0 0 0 0 76 77 1 0 0 0 0 76 78 2 0 0 0 0 80 79 1 0 0 0 0 81 79 1 0 0 0 0 82 80 1 0 0 0 0 83 81 1 0 0 0 0 84 82 1 0 0 0 0 84 83 1 0 0 0 0 81 50 1 6 0 0 0 86 85 2 0 0 0 0 87 85 1 0 0 0 0 81 85 1 1 0 0 0 80 88 1 6 0 0 0 82 89 1 1 0 0 0 89 90 1 0 0 0 0 90 91 1 0 0 0 0 90 92 2 0 0 0 0 84 93 1 0 0 0 0 93 94 1 0 0 0 0 94 95 1 0 0 0 0 95 96 1 0 0 0 0 94 97 1 1 0 0 0 93 98 1 6 0 0 0 84 99 1 1 0 0 0 21100 1 0 0 0 0 100101 1 0 0 0 0 101102 1 0 0 0 0 102103 1 0 0 0 0 103104 1 0 0 0 0 104105 1 0 0 0 0 105106 1 0 0 0 0 106107 1 0 0 0 0 107108 1 0 0 0 0 M END > CHEBI:61048 > ganglioside GM1 > A sialotetraosylceramide consisting of a branched pentasaccharide made up from one sialyl residue, two galactose residues, one N-acetylgalactosamine residue and a glucose residue at the reducing end attached to N-stearoylsphingosine via a ?-linkage. > 3 > Sialosylganglio-N-tetraosylceramide; Monosialosyl tetraglycosyl ceramide; monosialoganglioside GM1; monosialoganglioside GM1; GM1 ganglioside; GM1; GM1; Ganglioside M1; Ganglioside GM1a; Ganglioside GM1 (18:1/18:0); ganglioside GM1; Ganglioside GM1; Ganglioside GI; Ganglioside GGtet1; Ganglioside G4; Ganglioside A2; Galbeta1->3GalNAcbeta1->4(NeuAcalpha2->3)Galbeta1->4Glc-Cer; Galbeta1->3GalNAcbeta1->4(Neu5Acalpha2->3)Galbeta1->4Glcbeta1->1-Cer; G(M1) Ganglioside; alpha-Neup5Ac-(2->3)-[beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)]-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-N-stearoylsphingosine; alpha-Neu5Ac-(2->3)-[beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-N-stearoylsphingosine; alpha-Neu5Ac-(2->3)-[beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-N-octadecanoylsphingosine; (Neu5Ac)GM1 > (2S,3R,4E)-3-hydroxy-2-(octadecanoylamino)octadec-4-en-1-yl 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-galactopyranosyl-(1->4)]-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranoside > C73H131N3O31 > 1546.82270 > 1545.87665 > 0 > CCCCCCCCCCCCCCCCCC(=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[C@H](O)[C@@H](NC(C)=O)[C@@H](O3)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC > InChI=1S/C73H131N3O31/c1-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-52(87)76-44(45(84)33-31-29-27-25-23-21-18-16-14-12-10-8-6-2)41-98-69-61(94)59(92)63(50(39-80)101-69)103-71-62(95)67(107-73(72(96)97)35-46(85)53(74-42(3)82)66(106-73)55(88)47(86)36-77)64(51(40-81)102-71)104-68-54(75-43(4)83)65(57(90)49(38-79)99-68)105-70-60(93)58(91)56(89)48(37-78)100-70/h31,33,44-51,53-71,77-81,84-86,88-95H,5-30,32,34-41H2,1-4H3,(H,74,82)(H,75,83)(H,76,87)(H,96,97)/b33-31+/t44-,45+,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-,73-/m0/s1 > QPJBWNIQKHGLAU-IQZHVAEDSA-N > 37758-47-7 > 7196494 > 37758-47-7 > GM1 > 1567198; 1724444; 17855742; 19221437; 2448252; 24841627; 27242221; 27485170; 7691279; 8120143; 8410057; 8448384 $$$$