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الاسم: Bis-(8-methoxycarbonyl-2,2,6,6-tetramethylbenzo[1,2-d:4,5-d']-bis(1,3)dioxol-4-yl)-mono-(8-methoxycarbonyl-2,2,6,6-tetramethylbenzo[1,2-d:4,5-d']-bis(1,3)dithiol-4-yl)methanol

IUPAC: methyl 8-[hydroxy-(4-methoxycarbonyl-2,2,6,6-tetramethyl-[1,3]dioxolo[4,5-f][1,3]benzodioxol-8-yl)-(4-methoxycarbonyl-2,2,6,6-tetramethyl-[1,3]dithiolo[4,5-f][1,3]benzodithiol-8-yl)methyl]-2,2,6,6-tetramethyl-[1,3]dioxolo[4,5-f][1,3]benzodioxole-4-carboxylate

SMILES: COC(=O)c1c2c(c(C(O)(c3c4c(c(C(=O)OC)c5c3OC(C)(C)O5)OC(C)(C)O4)c3c4c(c(C(=O)OC)c5c3SC(C)(C)S5)SC(C)(C)S4)c3c1OC(C)(C)O3)OC(C)(C)O2

Canonical SMILES: CC1(OC2=C(C3=C(C(=C2O1)C(C4=C5C(=C(C6=C4OC(O6)(C)C)C(=O)OC)OC(O5)(C)C)(C7=C8C(=C(C9=C7SC(S9)(C)C)C(=O)OC)SC(S8)(C)C)O)OC(O3)(C)C)C(=O)OC)C

الصيغة الجزيئية: C43H46O15S4

الوزن الجزيئي: 931.10

InChIKey: YVTSXLQFDXAFCH-UHFFFAOYSA-N

InChI: InChI=1S/C43H46O15S4/c1-37(2)51-22-16(34(44)48-13)23-27(56-38(3,4)52-23)19(26(22)55-37)43(47,20-28-24(53-39(5,6)57-28)17(35(45)49-14)25-29(20)58-40(7,8)54-25)21-32-30(59-41(9,10)61-32)18(36(46)50-15)31-33(21)62-42(11,12)60-31/h47H,1-15H3

PubChem CID: 86752299 →

مرادفات

SCHEMBL8045612YVTSXLQFDXAFCH-UHFFFAOYSA-NBis-(8-methoxycarbonyl-2,2,6,6-tetramethylbenzo[1,2-d:4,5-d']-bis(1,3)dioxol-4-yl)-mono-(8-methoxycarbonyl-2,2,6,6-tetramethylbenzo[1,2-d:4,5-d']-bis(1,3)dithiol-4-yl)methanol

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