| SpectraBase Compound ID | A6qreYpTQ9e |
|---|---|
| InChI | InChI=1S/C44H59NO12/c1-7-8-12-23-36-43(4,5)41(56-38(50)26-31-20-13-11-14-21-31)40(51)44(53,57-36)32(28-46)42(52)45-25-18-17-19-29(2)39(54-6)30(3)35-27-33(47)34(55-35)22-15-9-10-16-24-37(48)49/h7-24,30,32-36,39-41,46-47,51,53H,25-28H2,1-6H3,(H,45,52)(H,48,49)/b8-7-,10-9+,18-17+,22-15+,23-12+,24-16+,29-19+/t30?,32?,33?,34?,35?,36-,39?,40+,41-,44+/m0/s1 |
| InChIKey | GBMNDYXFBDFBNN-CDTLSUQDSA-N |
| Mol Weight | 794.0 g/mol |
| Molecular Formula | C44H59NO12 |
| Exact Mass | 793.403726 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CqfaLfT1JLI |
|---|---|
| Name | GANEFROMYCIN-BETA-AGLYCONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H59NO12 |
| InChI | InChI=1S/C44H59NO12/c1-7-8-12-23-36-43(4,5)41(56-38(50)26-31-20-13-11-14-21-31)40(51)44(53,57-36)32(28-46)42(52)45-25-18-17-19-29(2)39(54-6)30(3)35-27-33(47)34(55-35)22-15-9-10-16-24-37(48)49/h7-24,30,32-36,39-41,46-47,51,53H,25-28H2,1-6H3,(H,45,52)(H,48,49)/b8-7-,10-9+,18-17+,22-15+,23-12+,24-16+,29-19+/t30?,32?,33?,34?,35?,36-,39?,40+,41-,44+/m0/s1 |
| InChIKey | GBMNDYXFBDFBNN-CDTLSUQDSA-N |
| Literature Reference Author | G.T.CARTER,M.TISCHLER,R.R.WEST,A.EBAILEY |
| Literature Reference Citation | J.ANTIBIOTICS,48,1312(1995) |
| Literature Reference DOI | 10.7164/antibiotics.48.1312 |
| Molecular Weight | 793.952 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWCS25395 |