| SpectraBase Compound ID | L0xhFM6hGiP |
|---|---|
| InChI | InChI=1S/C35H50N2O45S7.2Na/c1-10(38)36-16-22(20(78-85(52,53)54)14(8-68-83(46,47)48)71-32(16)70-13-6-4-12(67-3)5-7-13)73-34-26(81-88(61,62)63)18(40)24(28(76-34)30(42)43)75-33-17(37-11(2)39)23(21(79-86(55,56)57)15(72-33)9-69-84(49,50)51)74-35-27(82-89(64,65)66)19(41)25(80-87(58,59)60)29(77-35)31(44)45;;/h4-7,14-29,32-35,40-41H,8-9H2,1-3H3,(H,36,38)(H,37,39)(H,42,43)(H,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66);;/q;2*+1/p-2/t14-,15-,16-,17-,18-,19-,20+,21+,22-,23-,24-,25-,26+,27+,28-,29-,32-,33+,34+,35+;;/m0../s1 |
| InChIKey | CUHSZTDAIFVFQU-WAWLCOJKSA-L |
| Mol Weight | 1487.13753856 g/mol |
| Molecular Formula | C35H48N2Na2O45S7 |
| Exact Mass | 1485.936944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CGGSHzlYiNb |
|---|---|
| Name | #38-DISODIUM-SALT;4-METHOXYPHENYL-O-(2,4-DI-O-SULFO-BETA-D-GLUCOPYRANOSYLURONIC-ACID)-(1->3)-O-(2-ACETAMIDO-2-DEOXY-4,6-DI-O-SULFO-BETA-D-GALACTOPYRANOSIDE-DIS |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H48N2Na2O45S7 |
| InChI | InChI=1S/C35H50N2O45S7.2Na/c1-10(38)36-16-22(20(78-85(52,53)54)14(8-68-83(46,47)48)71-32(16)70-13-6-4-12(67-3)5-7-13)73-34-26(81-88(61,62)63)18(40)24(28(76-34)30(42)43)75-33-17(37-11(2)39)23(21(79-86(55,56)57)15(72-33)9-69-84(49,50)51)74-35-27(82-89(64,65)66)19(41)25(80-87(58,59)60)29(77-35)31(44)45;;/h4-7,14-29,32-35,40-41H,8-9H2,1-3H3,(H,36,38)(H,37,39)(H,42,43)(H,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66);;/q;2*+1/p-2/t14-,15-,16-,17-,18-,19-,20+,21+,22-,23-,24-,25-,26+,27+,28-,29-,32-,33+,34+,35+;;/m0../s1 |
| InChIKey | CUHSZTDAIFVFQU-WAWLCOJKSA-L |
| Literature Reference Author | G.MACCHIONE,S.MAZA,M.M.KAYSER,J.L.DEPAZ,P.M.NIETO |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2014,3868(2014) |
| Literature Reference DOI | 10.1002/ejoc.201402222 |
| Molecular Weight | 1487.152 g/mol |
| Solvent | D2O |
| Source File Reference | UWLU85338 |