| SpectraBase Compound ID | BlLE7a6nu03 |
|---|---|
| InChI | InChI=1S/C37H46O11/c1-19-26-17-27-32(43)33(45-22(4)39)20(2)31(36(27,7)8)34(46-23(5)40)35(47-24(6)41)37(26,9)29(44-21(3)38)18-28(19)48-30(42)16-15-25-13-11-10-12-14-25/h10-16,26-29,32-35,43H,1,17-18H2,2-9H3/b16-15+/t26-,27-,28+,29+,32-,33-,34-,35+,37+/m1/s1 |
| InChIKey | TYOWVKSVVMVWQN-IPOJINLQSA-N |
| Mol Weight | 666.8 g/mol |
| Molecular Formula | C37H46O11 |
| Exact Mass | 666.304012 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HZYbFC7lESl |
|---|---|
| Name | 14-BETA-HYDROXY-2-DEACETOXYTAXININE-J |
| Compound Number | 17 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H46O11 |
| InChI | InChI=1S/C37H46O11/c1-19-26-17-27-32(43)33(45-22(4)39)20(2)31(36(27,7)8)34(46-23(5)40)35(47-24(6)41)37(26,9)29(44-21(3)38)18-28(19)48-30(42)16-15-25-13-11-10-12-14-25/h10-16,26-29,32-35,43H,1,17-18H2,2-9H3/b16-15+/t26-,27-,28+,29+,32-,33-,34-,35+,37+/m1/s1 |
| InChIKey | TYOWVKSVVMVWQN-IPOJINLQSA-N |
| Literature Reference Author | D.A.SUN,F.SAURIOL,O.MAMER,L.O.ZAMIR |
| Literature Reference Citation | CAN.J.CHEM.,79,1381(2001) |
| Literature Reference DOI | 10.1139/cjc-79-9-1381 |
| Molecular Weight | 666.766 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI16201 |