SpectraBase Compound ID | 8WSfsStFt5n |
---|---|
InChI | InChI=1S/C30H48O6S/c1-25(2)14-16-30(24(31)32)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(36-37(33,34)35)26(3,4)21(27)10-13-29(22,28)7/h8,20-23H,9-18H2,1-7H3,(H,31,32)(H,33,34,35)/p-1/t20?,21?,22?,23-,27-,28+,29+,30-/m0/s1 |
InChIKey | HPTCFCREEHCWMI-FQRDBSNUSA-M |
Mol Weight | 535.8 g/mol |
Molecular Formula | C30H47O6S |
Exact Mass | 535.309335 g/mol |
SpectraBase Spectrum ID | GJ0UEhkqGWX |
---|---|
Name | OLEANOLIC-ACID-3-O-SULFATE |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C30H47O6S |
InChI | InChI=1S/C30H48O6S/c1-25(2)14-16-30(24(31)32)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(36-37(33,34)35)26(3,4)21(27)10-13-29(22,28)7/h8,20-23H,9-18H2,1-7H3,(H,31,32)(H,33,34,35)/p-1/t20?,21?,22?,23-,27-,28+,29+,30-/m0/s1 |
InChIKey | HPTCFCREEHCWMI-FQRDBSNUSA-M |
Literature Reference Author | E.AKAI,T.TAKEDO,Y.KOBAYASHI,Y.OGIHARA |
Literature Reference Citation | CHEM.PHARM.BULL.,33,3715(1985) |
Literature Reference DOI | 10.1248/cpb.33.3715 |
Molecular Weight | 535.760 g/mol |
Solvent | PYRIDINE-D5 |
Source File Reference | UWBK595 |