| SpectraBase Compound ID | 2HH9qZU0mJv |
|---|---|
| InChI | InChI=1S/C31H54O12/c1-3-4-5-6-8-11-14-17-23(18-15-12-9-7-10-13-16-19-25(33)34)41-31-30(43-27(37)20-26(35)36)29(39)28(38)24(42-31)21-40-22(2)32/h23-24,28-31,38-39H,3-21H2,1-2H3,(H,33,34)(H,35,36)/t23?,24-,28-,29+,30+,31-/m0/s1 |
| InChIKey | XVDLULKLSKWATQ-BXEKBIINSA-N |
| Mol Weight | 618.8 g/mol |
| Molecular Formula | C31H54O12 |
| Exact Mass | 618.361527 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | zjIzu0m91I |
|---|---|
| Name | SCH-484129 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H54O12 |
| InChI | InChI=1S/C31H54O12/c1-3-4-5-6-8-11-14-17-23(18-15-12-9-7-10-13-16-19-25(33)34)41-31-30(43-27(37)20-26(35)36)29(39)28(38)24(42-31)21-40-22(2)32/h23-24,28-31,38-39H,3-21H2,1-2H3,(H,33,34)(H,35,36)/t23?,24-,28-,29+,30+,31-/m0/s1 |
| InChIKey | XVDLULKLSKWATQ-BXEKBIINSA-N |
| Literature Reference Author | M.CHU,R.MIERZWA,L.XU,L.HE,E.LANGSDORF,M.BEYAZOWA,J.TERRACCIA NO,M.PATEL,T.M.CHAN, |
| Literature Reference Citation | J.ANTIBIOTICS,56,9(2003) |
| Literature Reference DOI | 10.7164/antibiotics.56.9 |
| Molecular Weight | 618.763 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI4404 |