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1,4-dioxo-3-[(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)thio]-1,4-dihydronaphthalen-2-yl 2,3,4,6-tetra-O-acetyl-1-thio-beta-D-glucopyranoside

Catalog ID
STL525336
SMILES CC(=O)OC[C@H]1O[C@@H](SC2=C(S[C@@H]3O[C@H](COC(=O)C)[C@H]([C@@H]([C@H]3OC(=O)C)OC(=O)C)OC(=O)C)C(=O)c3c(C2=O)cccc3)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C38H42O20S2 MW 882.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H42O20S2/c1-15(39)49-13-25-29(51-17(3)41)31(53-19(5)43)33(55-21(7)45)37(57-25)59-35-27(47)23-11-9-10-12-24(23)28(48)36(35)60-38-34(56-22(8)46)32(54-20(6)44)30(52-18(4)42)26(58-38)14-50-16(2)40/h9-12,25-26,29-34,37-38H,13-14H2,1-8H3/t25-,26-,29
InChIKey
PEOYQIDGVZEQEY-UXXPKRCFSA-N
Synonyms
125810-85-7
((2~(R)3~(R)4~(S)5~(R)6~(S))345triacetyloxy6(14dioxo3((2~(S)3~(R)4~(S)5~(R)6~(R))345triacetyloxy6(acetyloxymethyl)oxan2yl)sulfanylnaphthalen2yl)sulfanyloxan2yl)methylacetate
((2R3R4S5R6S)345tris(acetyloxy)6((14dioxo3(((2S3R4S5R6R)345tris(acetyloxy)6((acetyloxy)methyl)oxan2yl)sulfanyl)14dihydronaphthalen2yl)sulfanyl)oxan2yl)methylacetate
125810857
13831904
14dioxo3((2346tetraOacetylbetaDglucopyranosyl)thio)14dihydronaphthalen2yl2346tetraOacetyl1thiobetaDglucopyranoside
CC(=O)OC(C@H)1O(C@@H)(SC2=C(S(C@@H)3O(C@H)(COC(=O)C)(C@H)((C@@H)((C@H)3OC(=O)C)OC(=O)C)OC(=O)C)C(=O)c3c(C2=O)cccc3)(C@@H)((C@H)((C@@H)1OC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC38H42O20S2c115(39)49132529(5117(3)41)31(5319(5)43)33(5521(7)45)37(5725)593527(47)23119101224(23)28(48)36(35)603834(5622(8)46)32(5420(6)44)30(5218(4)42)26(5838)145016(2)40h912252629343738H1314H218H3t2526293031+32+333437+38+m1s1
MFCD01083793
ZINC000196785611
ZINC196785611

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Available files

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