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Ethyl 2'-(4'-O-Acetyl-2'-deoxy-3'-S-(2'',3'',4''.6''-tetra-O-acetyl-.beta.D-glucopyranosyl)-3'-thio-D-threo-pent-1'-enopyranosyl]thiazole-4-carboxylate

View entire compound with spectra: 1 MS (GC)

Ethyl 2'-(4'-O-Acetyl-2'-deoxy-3'-S-(2'',3'',4''.6''-tetra-O-acetyl-.beta.D-glucopyranosyl)-3'-thio-D-threo-pent-1'-enopyranosyl]thiazole-4-carboxylate
SpectraBase Compound ID 2ptSRB5SUes
InChI InChI=1S/C27H33NO14S2/c1-7-35-26(34)17-11-43-25(28-17)18-8-21(19(9-37-18)38-13(3)30)44-27-24(41-16(6)33)23(40-15(5)32)22(39-14(4)31)20(42-27)10-36-12(2)29/h8,11,19-24,27H,7,9-10H2,1-6H3
InChIKey WQJHYFQKIDONEK-UHFFFAOYSA-N
Mol Weight 659.7 g/mol
Molecular Formula C27H33NO14S2
Exact Mass 659.134247 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKg91ZdCwYp
Name Ethyl 2'-(4'-O-Acetyl-2'-deoxy-3'-S-(2'',3'',4''.6''-tetra-O-acetyl-.beta.D-glucopyranosyl)-3'-thio-D-threo-pent-1'-enopyranosyl]thiazole-4-carboxylate
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Formula C27H33NO14S2
InChI InChI=1S/C27H33NO14S2/c1-7-35-26(34)17-11-43-25(28-17)18-8-21(19(9-37-18)38-13(3)30)44-27-24(41-16(6)33)23(40-15(5)32)22(39-14(4)31)20(42-27)10-36-12(2)29/h8,11,19-24,27H,7,9-10H2,1-6H3
InChIKey WQJHYFQKIDONEK-UHFFFAOYSA-N
Molecular Weight 659.674 g/mol
SMILES C1(C(C(OC(=O)C)C(OC1SC1C=C(c2nc(C(=O)OCC)cs2)OCC1OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C
SPLASH splash10-000o-7690000000-ef4747e1e7534ed2a8fd
Source of Spectrum F-47-5558-8
Synonyms Ethyl 2'-(4'-O-acetyl-2'-deoxy-3'-S-(2'',3'',4''.6''-tetra-O-acetyl-.beta.d-glucopyranosyl)-3'-thio-D-threo-pent-1'-enopyranosyl]thiazole-4-carboxylate Ethyl 2-[3-(acetyloxy)-4-{[3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]sulfanyl}-3,4-dihydro-2H-pyran-6-yl]-1,3-thiazole-4-carboxylate
Wiley ID 1413519