| SpectraBase Compound ID | ItfuCQOO2UB |
|---|---|
| InChI | InChI=1S/C42H71NO34/c43-1-8-29-15(50)22(57)36(64-8)72-30-9(2-44)66-38(24(59)17(30)52)74-32-11(4-46)68-40(26(61)19(32)54)76-34-13(6-48)70-42(28(63)21(34)56)77-35-14(7-49)69-41(27(62)20(35)55)75-33-12(5-47)67-39(25(60)18(33)53)73-31-10(3-45)65-37(71-29)23(58)16(31)51/h8-42,44-63H,1-7,43H2/t8-,9+,10+,11+,12+,13+,14+,15-,16+,17+,18+,19+,20+,21+,22-,23+,24+,25+,26+,27+,28+,29-,30+,31+,32+,33+,34+,35+,36-,37+,38+,39+,40+,41+,42+/m0/s1 |
| InChIKey | OZBFLQITCMCIOY-MHGDMKFYSA-N |
| Mol Weight | 1134.0 g/mol |
| Molecular Formula | C42H71NO34 |
| Exact Mass | 1133.385748 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Jdf2QmhmOjY |
|---|---|
| Name | MONO-6'-DEOXY-6'-AMINO-CYCLOMALTOHEPTAOSE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H71NO34 |
| InChI | InChI=1S/C42H71NO34/c43-1-8-29-15(50)22(57)36(64-8)72-30-9(2-44)66-38(24(59)17(30)52)74-32-11(4-46)68-40(26(61)19(32)54)76-34-13(6-48)70-42(28(63)21(34)56)77-35-14(7-49)69-41(27(62)20(35)55)75-33-12(5-47)67-39(25(60)18(33)53)73-31-10(3-45)65-37(71-29)23(58)16(31)51/h8-42,44-63H,1-7,43H2/t8-,9+,10+,11+,12+,13+,14+,15-,16+,17+,18+,19+,20+,21+,22-,23+,24+,25+,26+,27+,28+,29-,30+,31+,32+,33+,34+,35+,36-,37+,38+,39+,40+,41+,42+/m0/s1 |
| InChIKey | OZBFLQITCMCIOY-MHGDMKFYSA-N |
| Literature Reference Author | C.K.JANKOWSKI,S.ARSENEAU,J.BLU,L.MAUCLAIRE,N.AYCHET |
| Literature Reference Citation | CAN.J.CHEM.,83,493(2005) |
| Literature Reference DOI | 10.1139/v05-070 |
| Molecular Weight | 1134.012 g/mol |
| Solvent | D2O |
| Source File Reference | UWVN27520 |