SpectraBase Compound ID | 7Ax66Qj17t9 |
---|---|
InChI | InChI=1S/C42H62O16/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54)/t19-,21+,22+,23+,24+,25+,26+,27-,28+,29+,30-,31-,34+,35-,38?,39+,40?,41?,42?/m1/s1 |
InChIKey | LPLVUJXQOOQHMX-UNKXMRJCSA-N |
Mol Weight | 822.9 g/mol |
Molecular Formula | C42H62O16 |
Exact Mass | 822.403786 g/mol |
SpectraBase Spectrum ID | JdpowKiQKBk |
---|---|
Name | GLYCYRRHIZIN |
Compound Number | 5B |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C42H62O16 |
InChI | InChI=1S/C42H62O16/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54)/t19-,21+,22+,23+,24+,25+,26+,27-,28+,29+,30-,31-,34+,35-,38?,39+,40?,41?,42?/m1/s1 |
InChIKey | LPLVUJXQOOQHMX-UNKXMRJCSA-N |
Literature Reference Author | T.ARAO,J.KINJO,T.NOHARA,R.ISOBE |
Literature Reference Citation | CHEM.PHARM.BULL.,45,362(1997) |
Literature Reference DOI | 10.1248/cpb.45.362 |
Molecular Weight | 822.945 g/mol |
Solvent | C5D5N |
Source File Reference | UWVN28742 |