| SpectraBase Compound ID | Cg9DWK7exkz |
|---|---|
| InChI | InChI=1S/C35H45NO11/c1-14-10-8-9-11-22(38)36-26-16(3)32(44)23-24(33(45)20(7)34(46)25(23)35(26)47)28(40)15(2)12-21(13-37)31(43)19(6)30(42)18(5)29(41)17(4)27(14)39/h8-12,14,17-19,21,27,29-31,37,39,41-43,45-46H,13H2,1-7H3,(H,36,38)/b10-8+,11-9-,15-12+/t14-,17+,18+,19-,21+,27-,29+,30-,31+/m0/s1 |
| InChIKey | DKNKXGMUDKSFMM-RRFXWELOSA-N |
| Mol Weight | 655.7 g/mol |
| Molecular Formula | C35H45NO11 |
| Exact Mass | 655.299261 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AmkqOTBWRS9 |
|---|---|
| Name | CHAXAMYCIN_C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H45NO11 |
| InChI | InChI=1S/C35H45NO11/c1-14-10-8-9-11-22(38)36-26-16(3)32(44)23-24(33(45)20(7)34(46)25(23)35(26)47)28(40)15(2)12-21(13-37)31(43)19(6)30(42)18(5)29(41)17(4)27(14)39/h8-12,14,17-19,21,27,29-31,37,39,41-43,45-46H,13H2,1-7H3,(H,36,38)/b10-8+,11-9-,15-12+/t14-,17+,18+,19-,21+,27-,29+,30-,31+/m0/s1 |
| InChIKey | DKNKXGMUDKSFMM-RRFXWELOSA-N |
| Literature Reference Author | M.E.RATEB,W.E.HOUSSEN,M.ARNOLD,M.H.ABDELRAHMAN,H.DENG,W.T.A. HARRISON,C.K.OKORO,J |
| Literature Reference Citation | J.NAT.PROD.,74,1491(2011) |
| Literature Reference DOI | 10.1021/np200320u |
| Molecular Weight | 655.742 g/mol |
| Sample ID | 38497 |
| Solvent | DMSO-D6 |