Mrv1652310011601142D 118121 0 0 1 0 999 V2000 13.5749 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.8670 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1499 15.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2894 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.1525 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0039 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.1525 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7184 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.4380 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4328 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.4380 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1473 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.7235 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8618 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.7235 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5762 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.0091 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2907 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0052 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7197 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4341 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1486 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8631 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5775 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2920 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0065 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.0091 2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7210 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2946 3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4354 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2946 4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1499 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.5801 4.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.5801 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.5788 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.8657 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.2933 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.8657 6.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.0078 5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5775 15.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0065 12.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 7.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.2933 11.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.7223 7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1499 16.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.4367 6.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 32.1512 7.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 24.2920 15.6750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 25.7210 13.2000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 28.5788 8.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 28.5788 11.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 30.7223 5.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7210 16.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 24.2920 16.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 25.7210 14.0250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 25.0065 16.9125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 29.2933 9.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 27.1499 11.5500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 30.0078 9.0750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 27.1499 10.7250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 27.1499 14.0250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 28.5788 9.0750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 27.8644 11.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 26.4354 14.4375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 25.7210 15.6750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 30.0078 8.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 27.8644 10.3125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 27.1499 13.2000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 26.4354 16.9125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 31.4367 5.7750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.5775 14.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.2920 13.2000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 7.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.0078 11.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 16.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 32.1512 7.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.7223 4.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.5775 16.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.0065 14.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.0065 17.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.2933 10.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.4354 11.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.7223 9.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.4354 10.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 14.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.7223 7.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.0065 15.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.4354 12.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.2933 7.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.5788 10.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 9.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 12.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.4354 15.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 32.1512 5.3625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 33.5801 7.0125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 31.4367 7.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 32.1512 6.1875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5775 16.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.0065 13.6125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 8.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.5788 12.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.7210 17.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.2920 17.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.7210 14.8500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.0065 16.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.5788 9.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.1499 12.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 30.0078 9.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.4354 11.1375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.1499 14.8500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.2933 8.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 11.1375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.4354 13.6125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.4354 16.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 30.7223 8.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.1499 9.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.8644 13.6125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4 1 1 0 0 0 0 5 2 1 0 0 0 0 6 4 1 0 0 0 0 7 5 1 0 0 0 0 8 6 1 0 0 0 0 9 7 1 0 0 0 0 10 8 1 0 0 0 0 11 9 1 0 0 0 0 12 10 1 0 0 0 0 13 11 1 0 0 0 0 14 12 1 0 0 0 0 15 13 1 0 0 0 0 16 14 1 0 0 0 0 17 15 1 0 0 0 0 18 16 1 0 0 0 0 19 18 1 0 0 0 0 20 19 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 17 1 0 0 0 0 28 26 1 0 0 0 0 29 27 1 0 0 0 0 30 28 1 0 0 0 0 31 29 1 0 0 0 0 32 30 1 0 0 0 0 33 31 1 0 0 0 0 34 32 1 0 0 0 0 35 33 1 0 0 0 0 36 34 1 0 0 0 0 37 35 1 0 0 0 0 38 36 1 0 0 0 0 39 37 2 0 0 0 0 40 38 1 0 0 0 0 46 3 1 4 0 0 0 47 45 1 0 0 0 0 48 39 1 0 0 0 0 48 47 1 0 0 0 0 49 41 1 6 0 0 0 50 42 1 6 0 0 0 51 43 1 6 0 0 0 52 44 1 1 0 0 0 53 40 1 0 0 0 0 55 49 1 0 0 0 0 56 50 1 0 0 0 0 57 54 1 0 0 0 0 57 55 1 0 0 0 0 60 58 1 0 0 0 0 61 59 1 0 0 0 0 63 51 1 0 0 0 0 63 58 1 0 0 0 0 64 52 1 0 0 0 0 64 59 1 0 0 0 0 65 56 1 0 0 0 0 65 62 1 0 0 0 0 66 54 1 0 0 0 0 67 60 1 0 0 0 0 68 61 1 0 0 0 0 69 62 1 0 0 0 0 70 46 2 0 0 0 0 54 70 1 1 0 0 0 47 71 1 6 0 0 0 71 53 2 0 0 0 0 72 41 1 0 0 0 0 73 42 1 0 0 0 0 74 43 1 0 0 0 0 75 44 1 0 0 0 0 76 46 1 0 0 0 0 48 77 1 1 0 0 0 53 78 1 4 0 0 0 55 79 1 6 0 0 0 56 80 1 6 0 0 0 57 81 1 1 0 0 0 58 82 1 6 0 0 0 59 83 1 1 0 0 0 60 84 1 6 0 0 0 61 85 1 6 0 0 0 62 86 1 1 0 0 0 87 45 1 0 0 0 0 67 87 1 6 0 0 0 88 49 1 0 0 0 0 88 66 1 0 0 0 0 89 50 1 0 0 0 0 89 69 1 0 0 0 0 90 51 1 0 0 0 0 90 67 1 0 0 0 0 91 52 1 0 0 0 0 91 68 1 0 0 0 0 63 92 1 6 0 0 0 68 92 1 1 0 0 0 64 93 1 6 0 0 0 69 93 1 1 0 0 0 65 94 1 1 0 0 0 66 94 1 6 0 0 0 95 37 1 0 0 0 0 96 39 1 0 0 0 0 47 97 1 6 0 0 0 48 98 1 1 0 0 0 49 99 1 1 0 0 0 50100 1 1 0 0 0 51101 1 1 0 0 0 52102 1 6 0 0 0 54103 1 6 0 0 0 55104 1 1 0 0 0 56105 1 1 0 0 0 57106 1 1 0 0 0 58107 1 1 0 0 0 59108 1 6 0 0 0 60109 1 1 0 0 0 61110 1 1 0 0 0 62111 1 6 0 0 0 63112 1 6 0 0 0 64113 1 6 0 0 0 65114 1 1 0 0 0 66115 1 1 0 0 0 67116 1 1 0 0 0 68117 1 6 0 0 0 69118 1 6 0 0 0 M END > BMDB0004968 > bmdb > [H]\C(CCCCCCCCCCCCC)=C(\[H])[C@@]([H])(O)[C@]([H])(CO[C@]1([H])O[C@]([H])(CO)[C@@]([H])(O[C@]2([H])O[C@]([H])(CO)[C@]([H])(O[C@@]3([H])O[C@]([H])(CO)[C@]([H])(O)[C@]([H])(O[C@]4([H])O[C@]([H])(CO)[C@]([H])(O)[C@]([H])(O)[C@@]4([H])N=C(C)O)[C@@]3([H])O)[C@]([H])(O)[C@@]2([H])O)[C@]([H])(O)[C@]1([H])O)N=C(O)CCCCCCCCCCCCCCCCCCCCCCCC > InChI=1S/C69H128N2O23/c1-4-6-8-10-12-14-16-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-53(78)71-47(48(77)39-37-35-33-31-29-27-17-15-13-11-9-7-5-2)45-87-67-60(84)58(82)63(51(43-74)90-67)92-68-61(85)59(83)64(52(44-75)91-68)93-69-62(86)65(56(80)50(42-73)89-69)94-66-54(70-46(3)76)57(81)55(79)49(41-72)88-66/h37,39,47-52,54-69,72-75,77,79-86H,4-36,38,40-45H2,1-3H3,(H,70,76)(H,71,78)/b39-37+/t47-,48+,49+,50+,51+,52+,54+,55-,56-,57+,58+,59+,60-,61+,62+,63+,64-,65-,66-,67+,68-,69+/m0/s1 > BIDGDAHARPMCIU-FTLOSOSASA-N > C69H128N2O23 > 1353.774 > 1352.89078839 > 25 > 222 > 156.86586803953904 > 0 > 15 > 0 > 0 > N-[(2S,3R,4E)-1-{[(2R,3S,4R,5S,6R)-5-{[(2S,3R,4R,5R,6R)-5-{[(2R,3R,4S,5S,6R)-4-{[(2S,3R,4R,5R,6R)-4,5-dihydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)oxan-2-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-hydroxyoctadec-4-en-2-yl]pentacosanimidic acid > 5.35 > 9.134303606333336 > -4.76 > 1 > 4 > 0 > 5.998321155759319 > 5.35574840514092 > 2.599468057399675 > 402.01000000000016 > 348.9825999999997 > 52 > 0 > 2.36e-02 g/l > N-[(2S,3R,4E)-1-{[(2R,3S,4R,5S,6R)-5-{[(2S,3R,4R,5R,6R)-5-{[(2R,3R,4S,5S,6R)-4-{[(2S,3R,4R,5R,6R)-4,5-dihydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)oxan-2-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-hydroxyoctadec-4-en-2-yl]pentacosanimidic acid > 0 > BMDB0004968 > Tetrahexosylceramide (d18:1/25:0) > CQH; Cytolipin K; GalNAc-beta1->3Gal-alpha1->3Gal-beta1->4Glc-beta1->1'Cer; Ganglioside Gb4; Ganglioside GL 4; Gb4; Gb4Cer; Globo-N-tetraosylceramide; Globosidate; Globoside; Globoside Gb 4; Globoside GL 4; Globoside I; Globosidic acid; Globotetraosylceramide; iGb4Cer; N-Acetyl-D-galactosaminyl-1,3-D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide; N-Acetyl-delta-galactosaminyl-1,3-delta-galactosyl-1,4-delta-galactosyl-1,4-delta-glucosylceramide; N-Acetyl-galactosaminyl-1,3-D-galactosyl-1,4-D-galactosyl-1,4-D-glucosylceramide; N-Acetyl-galactosaminyl-1,3-delta-galactosyl-1,4-delta-galactosyl-1,4-delta-glucosylceramide; Parvovirus B19 receptor $$$$