| SpectraBase Compound ID | 4iLxZi8eiLl |
|---|---|
| InChI | InChI=1S/C24H42O62S14.14Na/c25-87(26,27)67-1-5-9(75-23-21(85-99(61,62)63)17(81-95(49,50)51)11(77-91(37,38)39)7(73-23)3-69-89(31,32)33)15(79-93(43,44)45)19(83-97(55,56)57)13(71-5)14-20(84-98(58,59)60)16(80-94(46,47)48)10(6(72-14)2-68-88(28,29)30)76-24-22(86-100(64,65)66)18(82-96(52,53)54)12(78-92(40,41)42)8(74-24)4-70-90(34,35)36;;;;;;;;;;;;;;/h5-24H,1-4H2,(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36)(H,37,38,39)(H,40,41,42)(H,43,44,45)(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;14*+1/p-14/t5-,6+,7-,8+,9-,10+,11-,12+,13-,14?,15+,16-,17+,18-,19+,20-,21-,22+,23-,24+;;;;;;;;;;;;;;/m1............../s1 |
| InChIKey | RKMDCGJGQHHYEY-OVYHVYEASA-A |
| Mol Weight | 2079.12276995 g/mol |
| Molecular Formula | C24H28Na14O62S14 |
| Exact Mass | 2077.369574 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1pDF1suolIG |
|---|---|
| Name | RKMDCGJGQHHYEY-OVYHVYEASA-A |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H28Na14O62S14 |
| InChI | InChI=1S/C24H42O62S14.14Na/c25-87(26,27)67-1-5-9(75-23-21(85-99(61,62)63)17(81-95(49,50)51)11(77-91(37,38)39)7(73-23)3-69-89(31,32)33)15(79-93(43,44)45)19(83-97(55,56)57)13(71-5)14-20(84-98(58,59)60)16(80-94(46,47)48)10(6(72-14)2-68-88(28,29)30)76-24-22(86-100(64,65)66)18(82-96(52,53)54)12(78-92(40,41)42)8(74-24)4-70-90(34,35)36;;;;;;;;;;;;;;/h5-24H,1-4H2,(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36)(H,37,38,39)(H,40,41,42)(H,43,44,45)(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;14*+1/p-14/t5-,6+,7-,8+,9-,10+,11-,12+,13-,14?,15+,16-,17+,18-,19+,20-,21-,22+,23-,24+;;;;;;;;;;;;;;/m1............../s1 |
| InChIKey | RKMDCGJGQHHYEY-OVYHVYEASA-A |
| Literature Reference Author | E.VISMARA,A.COLETTI,A.VALERIO,A.M.NAGGI,E.URSO,G.TORRI |
| Literature Reference Citation | MOLECULES,17,9912(2012) |
| Literature Reference DOI | 10.3390/molecules17089912 |
| Molecular Weight | 2079.146 g/mol |
| Sample ID | 1421 |
| Solvent | D2O |