SpectraBase Compound ID | GLbbmNV20EB |
---|---|
InChI | InChI=1S/C48H76O19/c1-20(2)21-10-15-48(43(61)67-41-36(58)32(54)30(52)24(19-50)63-41)17-16-46(6)22(28(21)48)8-9-26-45(5)13-12-27(44(3,4)25(45)11-14-47(26,46)7)64-42-38(34(56)33(55)37(65-42)39(59)60)66-40-35(57)31(53)29(51)23(18-49)62-40/h21-38,40-42,49-58H,1,8-19H2,2-7H3,(H,59,60)/t21-,22+,23+,24+,25-,26+,27-,28+,29+,30+,31-,32-,33-,34-,35+,36+,37-,38+,40-,41-,42+,45-,46+,47+,48-/m0/s1 |
InChIKey | TUJWKSZYJZQHGQ-UPDQMDQZSA-N |
Mol Weight | 957.1 g/mol |
Molecular Formula | C48H76O19 |
Exact Mass | 956.49808 g/mol |
SpectraBase Spectrum ID | L1I4j5CCt5P |
---|---|
Name | 3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCURONOPYRANOSYL]-28-O-(BETA-D-GLUCOPYRANOSYL)-BETULINIC-ACID |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C48H76O19 |
InChI | InChI=1S/C48H76O19/c1-20(2)21-10-15-48(43(61)67-41-36(58)32(54)30(52)24(19-50)63-41)17-16-46(6)22(28(21)48)8-9-26-45(5)13-12-27(44(3,4)25(45)11-14-47(26,46)7)64-42-38(34(56)33(55)37(65-42)39(59)60)66-40-35(57)31(53)29(51)23(18-49)62-40/h21-38,40-42,49-58H,1,8-19H2,2-7H3,(H,59,60)/t21-,22+,23+,24+,25-,26+,27-,28+,29+,30+,31-,32-,33-,34-,35+,36+,37-,38+,40-,41-,42+,45-,46+,47+,48-/m0/s1 |
InChIKey | TUJWKSZYJZQHGQ-UPDQMDQZSA-N |
Literature Reference Author | A.L.TAPONDJOU,T.MIYAMOTO,M.A.LACAILLE-DUBOIS |
Literature Reference Citation | PHYTOCHEM.,67,2126(2006) |
Literature Reference DOI | 10.1016/j.phytochem.2006.06.034 |
Molecular Weight | 957.120 g/mol |
Sample ID | 67127 |
Solvent | C5D5N |