2-[6-carboxy-2-(1,2-dihydroxyethyl)-4-hydroxy-6-[[6-[[3-hydroxy-5-(3-hydroxytetradecanoylamino)-4-(3-hydroxytetradecanoyloxy)-6-phosphonooxy-tetrahydropyran-2-yl]methoxy]-5-(3-hydroxytetradecanoylamino)-4-(3-hydroxytetradecanoyloxy)-3-phosphonooxy-tetrahydropyran-2-yl]methoxy]tetrahydropyran-3-yl]oxy-6-(1,2-dihydroxyethyl)-4,5-dihydroxy-tetrahydropyran-2-carboxylic acid

DESCRIPTION

Name: 2-[6-carboxy-2-(1,2-dihydroxyethyl)-4-hydroxy-6-[[6-[[3-hydroxy-5-(3-hydroxytetradecanoylamino)-4-(3-hydroxytetradecanoyloxy)-6-phosphonooxy-tetrahydropyran-2-yl]methoxy]-5-(3-hydroxytetradecanoylamino)-4-(3-hydroxytetradecanoyloxy)-3-phosphonooxy-tetrahydropyran-2-yl]methoxy]tetrahydropyran-3-yl]oxy-6-(1,2-dihydroxyethyl)-4,5-dihydroxy-tetrahydropyran-2-carboxylic acid

Molecular Formula: C₈₄H₁₅₄N₂O₃₇P₂

SMILES: CCCCCCCCCCCC(CC(=O)NC1C(C(C(OC1OP(=O)(O)O)COC2C(C(C(C(O2)COC3(CC(C(C(O3)C(CO)O)OC4(CC(C(C(O4)C(CO)O)O)O)C(=O)O)O)C(=O)O)OP(=O)(O)O)OC(=O)CC(CCCCCCCCCCC)O)NC(=O)CC(CCCCCCCCCCC)O)O)OC(=O)CC(CCCCCCCCCCC)O)O

InChI: InChI=1S/C84H154N2O37P2/c1-5-9-13-17-21-25-29-33-37-41-55(89)45-65(97)85-69-77(117-67(99)47-57(91)43-39-35-31-27-23-19-15-11-7-3)72(102)63(115-80(69)123-125(110,111)112)53-113-79-70(86-66(98)46-56(90)42-38-34-30-26-22-18-14-10-6-2)78(118-68(100)48-58(92)44-40-36-32-28-24-20-16-12-8-4)76(122-124(107,108)109)64(116-79)54-114-83(81(103)104)50-60(94)74(75(120-83)62(96)52-88)121-84(82(105)106)49-59(93)71(101)73(119-84)61(95)51-87/h55-64,69-80,87-96,101-102H,5-54H2,1-4H3,(H,85,97)(H,86,98)(H,103,104)(H,105,106)(H2,107,108,109)(H2,110,111,112)

InChI Key: XYRZRSGHCARAIB-UHFFFAOYSA-N

Molecular Weight: 1846.1

Compound ID: 822