| SpectraBase Compound ID | 5PCSIFuH5CV |
|---|---|
| InChI | InChI=1S/C33H54O12/c1-14-13-42-33(10-19(14)35)15(2)25-21(45-33)8-18-16-7-24(37)32(41)9-20(36)22(11-31(32,4)17(16)5-6-30(18,25)3)43-29-28(40)27(39)26(38)23(12-34)44-29/h14-29,34-41H,5-13H2,1-4H3/t14-,15-,16+,17-,18-,19-,20+,21-,22+,23-,24+,25-,26-,27+,28-,29-,30-,31+,32-,33+/m0/s1 |
| InChIKey | XIWOUXGYWLOWOG-DQWPAFQCSA-N |
| Mol Weight | 642.8 g/mol |
| Molecular Formula | C33H54O12 |
| Exact Mass | 642.361527 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AHGd5SMYACq |
|---|---|
| Name | (24S,25S)-5-ALPHA-SPIROSTANE-2-ALPHA,3-BETA,5,6-BETA,24-PENTOL-2-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 8A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H54O12 |
| InChI | InChI=1S/C33H54O12/c1-14-13-42-33(10-19(14)35)15(2)25-21(45-33)8-18-16-7-24(37)32(41)9-20(36)22(11-31(32,4)17(16)5-6-30(18,25)3)43-29-28(40)27(39)26(38)23(12-34)44-29/h14-29,34-41H,5-13H2,1-4H3/t14-,15-,16+,17-,18-,19-,20+,21-,22+,23-,24+,25-,26-,27+,28-,29-,30-,31+,32-,33+/m0/s1 |
| InChIKey | XIWOUXGYWLOWOG-DQWPAFQCSA-N |
| Literature Reference Author | Y.MIMAKI,M.KURODA,T.FUKASAWA,Y.SASHIDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,47,738(1999) |
| Literature Reference DOI | 10.1248/cpb.47.738 |
| Molecular Weight | 642.785 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU8027 |