SpectraBase Compound ID | EpLvYka4q8r |
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InChI | InChI=1S/C46H74O17/c1-21(2)14-22-17-57-46-19-45(20-58-46)23(37(46)44(22,7)55)8-9-28-42(5)12-11-29(41(3,4)27(42)10-13-43(28,45)6)61-40-36(63-38-33(53)31(51)26(16-48)60-38)35(24(49)18-56-40)62-39-34(54)32(52)30(50)25(15-47)59-39/h14,22-40,47-55H,8-13,15-20H2,1-7H3/t22?,23?,24-,25+,26-,27?,28?,29?,30+,31-,32-,33+,34+,35-,36+,37?,38-,39-,40-,42-,43+,44-,45-,46+/m0/s1 |
InChIKey | ZOFQVMPJZHCDBS-QBHGFFGZSA-N |
Mol Weight | 899.1 g/mol |
Molecular Formula | C46H74O17 |
Exact Mass | 898.492601 g/mol |
SpectraBase Spectrum ID | 9KhGe52v7RW |
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Name | BACOPASAPONIN-C;3-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-[ALPHA-L-ARABINOFURANOSYL-(1->2)]-ALPHA-L-ARABINOFURANOSYL]-PSEUDOJUJUBOGENIN |
Compound Number | 6 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C46H74O17 |
InChI | InChI=1S/C46H74O17/c1-21(2)14-22-17-57-46-19-45(20-58-46)23(37(46)44(22,7)55)8-9-28-42(5)12-11-29(41(3,4)27(42)10-13-43(28,45)6)61-40-36(63-38-33(53)31(51)26(16-48)60-38)35(24(49)18-56-40)62-39-34(54)32(52)30(50)25(15-47)59-39/h14,22-40,47-55H,8-13,15-20H2,1-7H3/t22?,23?,24-,25+,26-,27?,28?,29?,30+,31-,32-,33+,34+,35-,36+,37?,38-,39-,40-,42-,43+,44-,45-,46+/m0/s1 |
InChIKey | ZOFQVMPJZHCDBS-QBHGFFGZSA-N |
Literature Reference Author | S.GARAI,S.B.MAHATO,K.OHTANI,K.YAMASAKI |
Literature Reference Citation | PHYTOCHEM.,42,815(1996) |
Literature Reference DOI | 10.1016/0031-9422(95)00936-1 |
Molecular Weight | 899.083 g/mol |
Solvent | C5D5N |
Source File Reference | UWLU3606 |