SpectraBase Compound ID | 6QTUkcbIdu3 |
---|---|
InChI | InChI=1S/C42H68O16/c1-37(17-44)15-20-19-7-8-23-39(3)11-10-24(40(4,18-45)22(39)9-12-42(23,6)41(19,5)14-13-38(20,2)33(52)32(37)51)56-36-31(28(49)27(48)30(57-36)34(53)54)58-35-29(50)26(47)25(46)21(16-43)55-35/h7,20-33,35-36,43-52H,8-18H2,1-6H3,(H,53,54)/t20-,21+,22?,23?,24-,25+,26-,27-,28-,29+,30-,31+,32-,33+,35-,36+,37+,38+,39-,40+,41+,42+/m0/s1 |
InChIKey | BMTGRKBINRYRJH-YAMXLXSKSA-N |
Mol Weight | 829.0 g/mol |
Molecular Formula | C42H68O16 |
Exact Mass | 828.450736 g/mol |
SpectraBase Spectrum ID | 2y5qXKYhK44 |
---|---|
Name | KUDZUSAPONIN-A4;3-O-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL-KUDZUSAPOGENOL-A |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C42H68O16 |
InChI | InChI=1S/C42H68O16/c1-37(17-44)15-20-19-7-8-23-39(3)11-10-24(40(4,18-45)22(39)9-12-42(23,6)41(19,5)14-13-38(20,2)33(52)32(37)51)56-36-31(28(49)27(48)30(57-36)34(53)54)58-35-29(50)26(47)25(46)21(16-43)55-35/h7,20-33,35-36,43-52H,8-18H2,1-6H3,(H,53,54)/t20-,21+,22?,23?,24-,25+,26-,27-,28-,29+,30-,31+,32-,33+,35-,36+,37+,38+,39-,40+,41+,42+/m0/s1 |
InChIKey | BMTGRKBINRYRJH-YAMXLXSKSA-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 | 828.992 g/mol |
Solvent | C5D5N |
Source File Reference | UWVN28732 |