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β-D-Galactopyranoside, phenylmethyl 3-O-(N-acetyl-4,7,8,9-tetra-O-acetyl-1-methyl-α-neuraminosyl)-2,6-bis-O-(phenylmethyl)-

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Catalog No. : NC35065

CAS No. : 96520-15-9

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Molecular Formula : C₄₇H₅₇NO₁₈

Chemical Name : β-D-Galactopyranoside, phenylmethyl 3-O-(N-acetyl-4,7,8,9-tetra-O-acetyl-1-methyl-α-neuraminosyl)-2,6-bis-O-(phenylmethyl)-

Molecular Weight : 923.95

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Basic information

Standard English name
Cas No.	96520-15-9
Alias	β-D-Galactopyranoside, phenylmethyl 3-O-(N-acetyl-4,7,8,9-tetra-O-acetyl-1-methyl-α-neuraminosyl)-2,6-bis-O-(phenylmethyl)-
Canonical Smiles	COC(=O)C1(CC(OC(C)=O)C(NC(C)=O)C(O1)C(OC(C)=O)C(COC(C)=O)OC(C)=O)OC1C(O)C(COCC2C=CC=CC=2)OC(OCC2C=CC=CC=2)C1OCC1C=CC=CC=1
MDL No.
Exact Mass	923.35757
Smiles	O=C(OCC(OC(=O)C)C(OC(=O)C)C1OC(OC2C(O)C(OC(OCC=3C=CC=CC3)C2OCC=4C=CC=CC4)COCC=5C=CC=CC5)(C(=O)OC)CC(OC(=O)C)C1NC(=O)C)C

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Inchi	InChI=1S/C47H57NO18/c1-28(49)48-39-36(61-30(3)51)22-47(46(55)56-6,65-42(39)41(63-32(5)53)38(62-31(4)52)27-58-29(2)50)66-43-40(54)37(26-57-23-33-16-10-7-11-17-33)64-45(60-25-35-20-14-9-15-21-35)44(43)59-24-34-18-12-8-13-19-34/h7-21,36-45,54H,22-27H2,1-6H3,(H,48,49)
InchiKey	XBVQBSJDYVOARF-UHFFFAOYSA-N
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