SpectraBase Compound ID | JMtGp2j2jfa |
---|---|
InChI | InChI=1S/C42H70O14/c1-19(2)21-14-23(46)35-41(7)11-8-20-28(40(41,6)12-13-42(21,35)18-44)22(45)15-26-38(3,4)27(9-10-39(20,26)5)56-37-34(52)32(50)30(48)25(55-37)17-53-36-33(51)31(49)29(47)24(16-43)54-36/h8,19,21-37,43-52H,9-18H2,1-7H3/t21-,22-,23+,24+,25+,26-,27-,28-,29+,30+,31-,32-,33+,34+,35+,36+,37-,39+,40-,41+,42+/m0/s1 |
InChIKey | AASNWSYGBVDYSL-REZAIECBSA-N |
Mol Weight | 799.0 g/mol |
Molecular Formula | C42H70O14 |
Exact Mass | 798.476557 g/mol |
SpectraBase Spectrum ID | CxaJv4HT80g |
---|---|
Name | RUBIARBOSIDE-G;3-BETA-[BETA-D-GLUCOPYRANOSYL-(6->1)-BETA-D-GLUCOPYRANOSYL]-7-BETA,19-ALPHA,28-TRIHYDROXYARBOR-9(11)-ENE |
Compound Number | 4 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C42H70O14 |
InChI | InChI=1S/C42H70O14/c1-19(2)21-14-23(46)35-41(7)11-8-20-28(40(41,6)12-13-42(21,35)18-44)22(45)15-26-38(3,4)27(9-10-39(20,26)5)56-37-34(52)32(50)30(48)25(55-37)17-53-36-33(51)31(49)29(47)24(16-43)54-36/h8,19,21-37,43-52H,9-18H2,1-7H3/t21-,22-,23+,24+,25+,26-,27-,28-,29+,30+,31-,32-,33+,34+,35+,36+,37-,39+,40-,41+,42+/m0/s1 |
InChIKey | AASNWSYGBVDYSL-REZAIECBSA-N |
Literature Reference Author | M.J.LIOU,T.S.WU |
Literature Reference Citation | J.NAT.PROD.,65,1283(2002) |
Literature Reference DOI | 10.1021/np020038k |
Molecular Weight | 799.009 g/mol |
Solvent | C5D5N |
Source File Reference | UWSI5183 |