| SpectraBase Compound ID | E13ZOKT5sqC |
|---|---|
| InChI | InChI=1S/C33H54O9/c1-16-7-10-33(39-15-16)17(2)26-24(42-33)12-21-19-6-5-18-11-23(40-30-29(38)28(37)27(36)25(14-34)41-30)22(35)13-32(18,4)20(19)8-9-31(21,26)3/h16-30,34-38H,5-15H2,1-4H3/t16-,17-,18-,19?,20?,21?,22+,23+,24?,25-,26?,27+,28+,29-,30-,31-,32-,33+/m0/s1 |
| InChIKey | YTZASGUOZDZYSL-OTFSMLJDSA-N |
| Mol Weight | 594.8 g/mol |
| Molecular Formula | C33H54O9 |
| Exact Mass | 594.376783 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HuSwEgM9Rld |
|---|---|
| Name | (25R)-5-ALPHA-SPIROSTANE-2-ALPHA,3-BETA-DIOL-3-O-BETA-D-GALACTOPYRANOSIDE;GITOGENIN-3-O-BETA-D-GALACTOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H54O9 |
| InChI | InChI=1S/C33H54O9/c1-16-7-10-33(39-15-16)17(2)26-24(42-33)12-21-19-6-5-18-11-23(40-30-29(38)28(37)27(36)25(14-34)41-30)22(35)13-32(18,4)20(19)8-9-31(21,26)3/h16-30,34-38H,5-15H2,1-4H3/t16-,17-,18-,19?,20?,21?,22+,23+,24?,25-,26?,27+,28+,29-,30-,31-,32-,33+/m0/s1 |
| InChIKey | YTZASGUOZDZYSL-OTFSMLJDSA-N |
| Literature Reference Author | Y.MIMAKI,M.KURODA,A.KAMEYAMA,A.YOKOSUKA,Y.SASHIDA |
| Literature Reference Citation | PHYTOCHEM.,48,1361(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00157-5 |
| Molecular Weight | 594.786 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS1474 |