| SpectraBase Compound ID | Bm6FCYYG4jm |
|---|---|
| InChI | InChI=1S/C27H43NO7S/c1-15-9-8-10-27(7,34)22(30)12-20(16(2)11-19-14-36-18(4)28-19)35-23(31)13-21(29)26(5,6)25(33)17(3)24(15)32/h11,14-15,17,20-22,24,29-30,32,34H,8-10,12-13H2,1-7H3/b16-11+/t15-,17-,20+,21+,22-,24-,27-/m1/s1 |
| InChIKey | RPHDBEKXMLDCAN-VJQFMIRWSA-N |
| Mol Weight | 525.7 g/mol |
| Molecular Formula | C27H43NO7S |
| Exact Mass | 525.276024 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EQBNIDcSX06 |
|---|---|
| Name | 12,13-DIHYDROXY-EPOTHILONE-B |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H43NO7S |
| InChI | InChI=1S/C27H43NO7S/c1-15-9-8-10-27(7,34)22(30)12-20(16(2)11-19-14-36-18(4)28-19)35-23(31)13-21(29)26(5,6)25(33)17(3)24(15)32/h11,14-15,17,20-22,24,29-30,32,34H,8-10,12-13H2,1-7H3/b16-11+/t15-,17-,20+,21+,22-,24-,27-/m1/s1 |
| InChIKey | RPHDBEKXMLDCAN-VJQFMIRWSA-N |
| Literature Reference Author | C.LU,L.ZHAO,Y.LI,Y.SHEN |
| Literature Reference Citation | J.CHIN.PHARM.SCI.,22,28(2013) |
| Molecular Weight | 525.701 g/mol |
| Source File Reference | UWIR7004 |