| SpectraBase Compound ID | HSvDDEhqFQS |
|---|---|
| InChI | InChI=1S/C32H42O8/c1-8-17(2)29(36)40-28-20-13-19-21(32(6,26(20)35)23(30(28,3)4)15-24(33)37-7)9-11-31(5)22(19)14-25(34)39-27(31)18-10-12-38-16-18/h10,12-13,16-17,20-23,27-28H,8-9,11,14-15H2,1-7H3/t17-,20+,21?,22?,23-,27-,28+,31+,32+/m0/s1 |
| InChIKey | VJNCOPXREONOMO-RKBWENLLSA-N |
| Mol Weight | 554.7 g/mol |
| Molecular Formula | C32H42O8 |
| Exact Mass | 554.287968 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KsV5F0cGyyQ |
|---|---|
| Name | 2'-S-CIPADESIN |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H42O8 |
| InChI | InChI=1S/C32H42O8/c1-8-17(2)29(36)40-28-20-13-19-21(32(6,26(20)35)23(30(28,3)4)15-24(33)37-7)9-11-31(5)22(19)14-25(34)39-27(31)18-10-12-38-16-18/h10,12-13,16-17,20-23,27-28H,8-9,11,14-15H2,1-7H3/t17-,20+,21?,22?,23-,27-,28+,31+,32+/m0/s1 |
| InChIKey | VJNCOPXREONOMO-RKBWENLLSA-N |
| Literature Reference Author | L.S.GAN,X.N.WANG,Y.WU,J.M.YUE |
| Literature Reference Citation | J.NAT.PROD.,70,1344(2007) |
| Literature Reference DOI | 10.1021/np070229t |
| Molecular Weight | 554.681 g/mol |
| Sample ID | 31471 |
| Solvent | CDCl3 |