Lipid A disaccharide bisphosphate

Molecular Formula: C₇₀H₁₃₆N₂O₂₃P₂

InChI: InChI=1/C68H130N2O23P2.C2H6/c1-5-9-13-17-21-25-29-33-37-41-51(71)45-57(75)69-61-65(91-59(77)47-53(73)43-39-35-31-27-23-19-15-11-7-3)64(80)56(50-88-94(81,82)83)89-67(61)87-49-55-63(79)66(92-60(78)48-54(74)44-40-36-32-28-24-20-16-12-8-4)62(68(90-55)93-95(84,85)86)70-58(76)46-52(72)42-38-34-30-26-22-18-14-10-6-2;1-2/h51-56,61-68,71-74,79-80H,5-50H2,1-4H3,(H,69,75)(H,70,76)(H2,81,82,83)(H2,84,85,86);1-2H3/t51?,52?,53?,54?,55-,56-,61-,62-,63-,64-,65-,66-,67-,68+;/m1./s1/f/h69-70,81-82,84-85H;

InChIKey: InChIKey=QMRFYSSNGZLBTH-PEJFEZSNDX
SMILES: CC.CCCCCCCCCCCC(CC(=O)NC1C(C(C(OC1OP(=O)(O)O)COC2C(C(C(C(O2)COP(=O)(O)O)O)OC(=O)CC(CCCCCCCCCCC)O)NC(=O)CC(CCCCCCCCCCC)O)O)OC(=O)CC(CCCCCCCCCCC)O)O

Names:
    CHEBI:29056
    ethane; [(2S,3R,4R,5R,6R)-5-hydroxy-6-[[(2R,3R,4R,5R,6R)-5-hydroxy-3-(3-hydroxytetradecanoylamino)-4-(3-hydroxytetradecanoyloxy)-6-(phosphonooxymethyl)oxan-2-yl]oxymethyl]-3-(3-hydroxytetradecanoylamino)-4-(3-hydroxytetradecanoyloxy)oxan-2-yl]oxyphosphonic acid
    Lipid A disaccharide bisphosphate
    lipid IV(A)
    2,3,2',3'-tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-beta-D-glucosamine 1,4'-bisphosphate
    2,3,2',3'-tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-beta-D-glucosamine 1,4'-bis(dihydrogen phosphate)
    2,3,2'3'-Tetrakis(beta-hydroxymyristoyl)-D-glucosaminyl-1,6-beta-D-glucosamine 1,4'-bisphosphate
    2,3,2'3'-Tetrakis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-beta-D-glucosamine 1,4'-bisphosphate
    2-deoxy-6-O-{2-deoxy-3-O-(3-hydroxytetradecanoyl)-2-[(3-hydroxytetradecanoyl)amino]-6-O-phosphono-beta-D-glucopyranosyl

Registries:
    PubChem CID 5460246
    PubChem ID 8145277