![1-O-[BETA-L-FUCOPYRANOSYL-(4'-SULFATE)]-25R,5-ALPHA-SPIROSTANE-1-BETA,3-BETA-DIOL](/api/spectrum/F6UU6wOZTXp/structure.png?h=300&w=458 "1-O-[BETA-L-FUCOPYRANOSYL-(4'-SULFATE)]-25R,5-ALPHA-SPIROSTANE-1-BETA,3-BETA-DIOL")
| SpectraBase Compound ID | 7CJhYN57WwF |
|---|---|
| InChI | InChI=1S/C33H54O11S/c1-16-8-11-33(40-15-16)17(2)26-24(43-33)14-23-21-7-6-19-12-20(34)13-25(32(19,5)22(21)9-10-31(23,26)4)42-30-28(36)27(35)29(18(3)41-30)44-45(37,38)39/h16-30,34-36H,6-15H2,1-5H3,(H,37,38,39)/t16-,17+,18-,19+,20-,21-,22+,23+,24+,25-,26+,27-,28-,29+,30+,31+,32+,33-/m1/s1 |
| InChIKey | VEBWDEUHONOFKN-PQBMEILMSA-N |
| Mol Weight | 658.8 g/mol |
| Molecular Formula | C33H54O11S |
| Exact Mass | 658.338684 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F6UU6wOZTXp |
|---|---|
| Name | 1-O-[BETA-L-FUCOPYRANOSYL-(4'-SULFATE)]-25R,5-ALPHA-SPIROSTANE-1-BETA,3-BETA-DIOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H54O11S |
| InChI | InChI=1S/C33H54O11S/c1-16-8-11-33(40-15-16)17(2)26-24(43-33)14-23-21-7-6-19-12-20(34)13-25(32(19,5)22(21)9-10-31(23,26)4)42-30-28(36)27(35)29(18(3)41-30)44-45(37,38)39/h16-30,34-36H,6-15H2,1-5H3,(H,37,38,39)/t16-,17+,18-,19+,20-,21-,22+,23+,24+,25-,26+,27-,28-,29+,30+,31+,32+,33-/m1/s1 |
| InChIKey | VEBWDEUHONOFKN-PQBMEILMSA-N |
| Literature Reference Author | A.D.PATIL,P.W.BAURES,D.S.EGGLESTONE,L.FAUCETTE,M.E.HEMLING,J .W.WESTLEY,R.K.JOHNS |
| Literature Reference Citation | J.NAT.PROD.,56,1451(1993) |
| Literature Reference DOI | 10.1021/np50099a003 |
| Molecular Weight | 658.845 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS17888 |