| SpectraBase Compound ID | LwqV9jDyZw |
|---|---|
| InChI | InChI=1S/C34H28Br4N4O11S.Na/c35-21-9-17-2-4-28(21)51-29-15-18(1-3-27(29)43)6-8-40-34(45)26(42-47)14-20-12-24(38)32(53-54(48,49)50)30(16-20)52-31-22(36)10-19(11-23(31)37)13-25(41-46)33(44)39-7-5-17;/h1-4,9-12,15-16,43,46-47H,5-8,13-14H2,(H,39,44)(H,40,45)(H,48,49,50);/q;+1/p-1/b41-25-,42-26+; |
| InChIKey | CJHYNEZGMLQMEZ-FMFWWSKISA-M |
| Mol Weight | 1042.3 g/mol |
| Molecular Formula | C34H27Br4N4NaO11S |
| Exact Mass | 1037.802825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EiDGGRRmPHi |
|---|---|
| Name | 34-SULFATOBASTADIN-13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H25Br4N4NaO11S |
| InChI | InChI=1S/C34H28Br4N4O11S.Na/c35-21-9-17-2-4-28(21)51-29-15-18(1-3-27(29)43)6-8-40-34(45)26(42-47)14-20-12-24(38)32(53-54(48,49)50)30(16-20)52-31-22(36)10-19(11-23(31)37)13-25(41-46)33(44)39-7-5-17;/h1-4,9-12,15-16,43,46-47H,5-8,13-14H2,(H,39,44)(H,40,45)(H,48,49,50);/q;+1/p-1/b41-25-,42-26+; |
| InChIKey | CJHYNEZGMLQMEZ-FMFWWSKISA-M |
| Literature Reference Author | N.K.GULAVITA,A.E.WRIGHT,P.J.MCCARTHY,S.A.POMPONI,M.KELLY-BOR GES,M.CHIN,M.A.SILLS |
| Literature Reference Citation | J.NAT.PROD.,56,1613(1993) |
| Literature Reference DOI | 10.1021/np50099a026 |
| Molecular Weight | 1040.258 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS5333 |