| SpectraBase Compound ID | 4DYSskmJCEg |
|---|---|
| InChI | InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23-,24-,25+,26+,27-,28+,31+,32+,33-,34-,35+/m1/s1 |
| InChIKey | QUBNLZCADIYAFW-DIGDUKAWSA-N |
| Mol Weight | 604.8 g/mol |
| Molecular Formula | C35H56O8 |
| Exact Mass | 604.397519 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EXEtTG5n3xw |
|---|---|
| Name | 3-O-ALPHA-L-ARABINOPYRANOSYL-HEDERAGENIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H56O8 |
| InChI | InChI=1S/C35H56O8/c1-30(2)13-15-35(29(40)41)16-14-33(5)20(21(35)17-30)7-8-24-31(3)11-10-25(43-28-27(39)26(38)22(37)18-42-28)32(4,19-36)23(31)9-12-34(24,33)6/h7,21-28,36-39H,8-19H2,1-6H3,(H,40,41)/t21-,22+,23-,24-,25+,26+,27-,28+,31+,32+,33-,34-,35+/m1/s1 |
| InChIKey | QUBNLZCADIYAFW-DIGDUKAWSA-N |
| Literature Reference Author | S.KITANAKA,I.YASUDA,Y.KASHIWADA,C.Q.HU,K.F.BASTOW,I.D.BORI,K .H.LEE |
| Literature Reference Citation | J.NAT.PROD.,58,1647(1995) |
| Literature Reference DOI | 10.1021/np50125a001 |
| Molecular Weight | 604.825 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWCS22901 |