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3-oxo-2-phenyl-5-[(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)thio]-2,3-dihydropyridazin-4-yl 2,3,4,6-tetra-O-acetyl-1-thio-beta-D-glucopyranoside

Catalog ID
STL553384
SMILES CC(=O)OC[C@H]1O[C@@H](Sc2cnn(c(=O)c2S[C@@H]2O[C@H](COC(=O)C)[C@H]([C@@H]([C@H]2OC(=O)C)OC(=O)C)OC(=O)C)c2ccccc2)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C

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We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C38H44N2O19S2 MW 896.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H44N2O19S2/c1-17(41)50-15-26-29(52-19(3)43)31(54-21(5)45)33(56-23(7)47)37(58-26)60-28-14-39-40(25-12-10-9-11-13-25)36(49)35(28)61-38-34(57-24(8)48)32(55-22(6)46)30(53-20(4)44)27(59-38)16-51-18(2)42/h9-14,26-27,29-34,37-38H,15-16H2,1-8H3/t26-,2
InChIKey
JKCJSQKIASUTKA-SFAJPICVSA-N
Synonyms
956961-35-6
((2~(R)3~(R)4~(S)5~(R)6~(S))345triacetyloxy6(6oxo1phenyl5((2~(S)3~(R)4~(S)5~(R)6~(R))345triacetyloxy6(acetyloxymethyl)oxan2yl)sulfanylpyridazin4yl)sulfanyloxan2yl)methylacetate
((2R3R4S5R6S)345tris(acetyloxy)6((3oxo2phenyl5(((2S3R4S5R6R)345tris(acetyloxy)6((acetyloxy)methyl)oxan2yl)sulfanyl)23dihydropyridazin4yl)sulfanyl)oxan2yl)methylacetate
16406259
3oxo2phenyl5((2346tetraOacetylbetaDglucopyranosyl)thio)23dihydropyridazin4yl2346tetraOacetyl1thiobetaDglucopyranoside
956961356
CC(=O)OC(C@H)1O(C@@H)(Sc2cnn(c(=O)c2S(C@@H)2O(C@H)(COC(=O)C)(C@H)((C@@H)((C@H)2OC(=O)C)OC(=O)C)OC(=O)C)c2ccccc2)(C@@H)((C@H)((C@@H)1OC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC38H44N2O19S2c117(41)50152629(5219(3)43)31(5421(5)45)33(5623(7)47)37(5826)6028143940(2512109111325)36(49)35(28)613834(5724(8)48)32(5522(6)46)30(5320(4)44)27(5938)165118(2)42h914262729343738H1516H218H3t2627293031+32+333437+38+m1s1
ZINC000196073761
ZINC196073761

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Available files

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