![TRIS-(2-[3-[6'-DEOXY-1'-O-(PARA-NITROPHENYL)-ALPHA-D-MANNOPYRANOS-6'-YL]-THIOUREIDO]-ETHYL)-AMINE](/api/spectrum/DC99cSros6N/structure.png?h=300&w=458 "TRIS-(2-[3-[6'-DEOXY-1'-O-(PARA-NITROPHENYL)-ALPHA-D-MANNOPYRANOS-6'-YL]-THIOUREIDO]-ETHYL)-AMINE")
| SpectraBase Compound ID | Fy244bKTLxb |
|---|---|
| InChI | InChI=1S/C45H60N10O21S3/c56-31-28(74-40(37(62)34(31)59)71-25-7-1-22(2-8-25)53(65)66)19-49-43(77)46-13-16-52(17-14-47-44(78)50-20-29-32(57)35(60)38(63)41(75-29)72-26-9-3-23(4-10-26)54(67)68)18-15-48-45(79)51-21-30-33(58)36(61)39(64)42(76-30)73-27-11-5-24(6-12-27)55(69)70/h1-12,28-42,56-64H,13-21H2,(H2,46,49,77)(H2,47,50,78)(H2,48,51,79)/t28-,29-,30+,31-,32-,33+,34+,35+,36-,37+,38+,39-,40+,41+,42-/m0/s1 |
| InChIKey | MMWFMJCOHCCHEU-HGMHJNPLSA-N |
| Mol Weight | 1173.2 g/mol |
| Molecular Formula | C45H60N10O21S3 |
| Exact Mass | 1172.309662 g/mol |
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| SpectraBase Spectrum ID | DC99cSros6N |
|---|---|
| Name | TRIS-(2-[3-[6'-DEOXY-1'-O-(PARA-NITROPHENYL)-ALPHA-D-MANNOPYRANOS-6'-YL]-THIOUREIDO]-ETHYL)-AMINE |
| Compound Number | 24 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H60N10O21S3 |
| InChI | InChI=1S/C45H60N10O21S3/c56-31-28(74-40(37(62)34(31)59)71-25-7-1-22(2-8-25)53(65)66)19-49-43(77)46-13-16-52(17-14-47-44(78)50-20-29-32(57)35(60)38(63)41(75-29)72-26-9-3-23(4-10-26)54(67)68)18-15-48-45(79)51-21-30-33(58)36(61)39(64)42(76-30)73-27-11-5-24(6-12-27)55(69)70/h1-12,28-42,56-64H,13-21H2,(H2,46,49,77)(H2,47,50,78)(H2,48,51,79)/t28-,29-,30+,31-,32-,33+,34+,35+,36-,37+,38+,39-,40+,41+,42-/m0/s1 |
| InChIKey | MMWFMJCOHCCHEU-HGMHJNPLSA-N |
| Literature Reference Author | S.KOETTER,U.KRALLMANN-WENZEL,S.EHLERS,T.K.LINDHORST |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,2193(1998) |
| Literature Reference DOI | 10.1039/a801985a |
| Molecular Weight | 1173.206 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWPA521 |