| SpectraBase Compound ID | 98FDcxS7rSE |
|---|---|
| InChI | InChI=1S/C42H70O13/c1-22(2)9-8-15-41(7,51)24-12-16-39(5)23(24)10-11-28-40(39,6)17-13-27-38(3,4)29(14-18-42(27,28)21-45)54-37-35(33(49)31(47)26(20-44)53-37)55-36-34(50)32(48)30(46)25(19-43)52-36/h9,21,23-37,43-44,46-51H,8,10-20H2,1-7H3/t23?,24?,25-,26-,27?,28?,29+,30-,31-,32+,33+,34-,35-,36+,37+,39?,40?,41?,42-/m1/s1 |
| InChIKey | DOUGLYJWNNDEQP-XVLHZPSBSA-N |
| Mol Weight | 783.0 g/mol |
| Molecular Formula | C42H70O13 |
| Exact Mass | 782.481642 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LgZwLdu5tSY |
|---|---|
| Name | GYPENOSIDE-XXVIII;19-OXO-3-BETA,20S-DIHYDROXY-DAMMAR-24-ENE-3-O-BETA-SOPHOROSIDE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H70O13 |
| InChI | InChI=1S/C42H70O13/c1-22(2)9-8-15-41(7,51)24-12-16-39(5)23(24)10-11-28-40(39,6)17-13-27-38(3,4)29(14-18-42(27,28)21-45)54-37-35(33(49)31(47)26(20-44)53-37)55-36-34(50)32(48)30(46)25(19-43)52-36/h9,21,23-37,43-44,46-51H,8,10-20H2,1-7H3/t23?,24?,25-,26-,27?,28?,29+,30-,31-,32+,33+,34-,35-,36+,37+,39?,40?,41?,42-/m1/s1 |
| InChIKey | DOUGLYJWNNDEQP-XVLHZPSBSA-N |
| Literature Reference Author | K.YOSHIKAWA,S.ARIHARA,K.MATSUURA,T.MIYASE |
| Literature Reference Citation | PHYTOCHEM.,31,237(1992) |
| Literature Reference DOI | 10.1016/0031-9422(91)83044-L |
| Molecular Weight | 783.010 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU5283 |