| SpectraBase Compound ID | ZCG7o0vaOs |
|---|---|
| InChI | InChI=1S/C39H50O24/c1-12-23(43)28(48)32(52)36(57-12)56-11-21-27(47)31(51)35(63-38-34(54)30(50)26(46)20(9-41)61-38)39(62-21)58-14-4-2-13(3-5-14)16-10-55-18-7-15(6-17(42)22(18)24(16)44)59-37-33(53)29(49)25(45)19(8-40)60-37/h2-7,10,12,19-21,23,25-43,45-54H,8-9,11H2,1H3/t12-,19-,20-,21-,23-,25-,26-,27-,28+,29+,30+,31+,32+,33-,34-,35-,36+,37-,38+,39-/m0/s1 |
| InChIKey | OLHAWKMGGHPTPD-QXZZZIMASA-N |
| Mol Weight | 902.8 g/mol |
| Molecular Formula | C39H50O24 |
| Exact Mass | 902.269202 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9RA9hTZFOqn |
|---|---|
| Name | GENISTEIN_7-O-BETA-D-GLUCOPYRANOSIDE-4'-O-(6'''-O-ALPHA-L-RHAMNOPYRANOYL)-BETA-SOPHOROSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H50O24 |
| InChI | InChI=1S/C39H50O24/c1-12-23(43)28(48)32(52)36(57-12)56-11-21-27(47)31(51)35(63-38-34(54)30(50)26(46)20(9-41)61-38)39(62-21)58-14-4-2-13(3-5-14)16-10-55-18-7-15(6-17(42)22(18)24(16)44)59-37-33(53)29(49)25(45)19(8-40)60-37/h2-7,10,12,19-21,23,25-43,45-54H,8-9,11H2,1H3/t12-,19-,20-,21-,23-,25-,26-,27-,28+,29+,30+,31+,32+,33-,34-,35-,36+,37-,38+,39-/m0/s1 |
| InChIKey | OLHAWKMGGHPTPD-QXZZZIMASA-N |
| Literature Reference Author | Y.TANG,R.YANG,J.DUAN,E.SHANG,S.SU,M.ZHU,D.QIAN |
| Literature Reference Citation | J.NAT.PROD.,71,448(2008) |
| Literature Reference DOI | 10.1021/np070396t |
| Molecular Weight | 902.812 g/mol |
| Sample ID | 27475 |
| Solvent | DMSO-D6 |