SpectraBase Compound ID | Fgwj87UvNq5 |
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InChI | InChI=1S/C42H70O12/c1-21(2)10-9-11-22(3)23-12-16-42(8)30(23)24(45)18-28-40(6)15-14-29(39(4,5)27(40)13-17-41(28,42)7)53-38-36(34(49)32(47)26(20-44)52-38)54-37-35(50)33(48)31(46)25(19-43)51-37/h10,23-38,43-50H,3,9,11-20H2,1-2,4-8H3/t23?,24-,25-,26-,27?,28?,29+,30?,31-,32-,33+,34+,35-,36-,37+,38+,40+,41-,42+/m1/s1 |
InChIKey | KWDWBAISZWOAHD-LBTKNHCGSA-N |
Mol Weight | 767.0 g/mol |
Molecular Formula | C42H70O12 |
Exact Mass | 766.486728 g/mol |
SpectraBase Spectrum ID | 1j4EsGIezTa |
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Name | GINSENOSIDE_RK1 |
Compound Number | 2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C42H70O12 |
InChI | InChI=1S/C42H70O12/c1-21(2)10-9-11-22(3)23-12-16-42(8)30(23)24(45)18-28-40(6)15-14-29(39(4,5)27(40)13-17-41(28,42)7)53-38-36(34(49)32(47)26(20-44)52-38)54-37-35(50)33(48)31(46)25(19-43)51-37/h10,23-38,43-50H,3,9,11-20H2,1-2,4-8H3/t23?,24-,25-,26-,27?,28?,29+,30?,31-,32-,33+,34+,35-,36-,37+,38+,40+,41-,42+/m1/s1 |
InChIKey | KWDWBAISZWOAHD-LBTKNHCGSA-N |
Literature Reference Author | J.W.LIU,S.J.TIAN,J.DEBARRY,B.LUU |
Literature Reference Citation | J.NAT.PROD.,70,1329(2007) |
Literature Reference DOI | 10.1021/np070135j |
Molecular Weight | 767.011 g/mol |
Sample ID | 31432 |
Solvent | C5D5N |