| SpectraBase Compound ID | 8i4loWElP9y |
|---|---|
| InChI | InChI=1S/C25H38O4/c1-22(2)10-6-11-23(3)15(22)9-12-24(4)16-8-7-14-19(21(28)29-20(14)27)25(16,5)18(26)13-17(23)24/h7,15-19,21,26,28H,6,8-13H2,1-5H3/t15?,16-,17+,18+,19+,21+,23-,24-,25+/m0/s1 |
| InChIKey | ATVQOEWPZTUPDT-IZEIGIMZSA-N |
| Mol Weight | 402.6 g/mol |
| Molecular Formula | C25H38O4 |
| Exact Mass | 402.27701 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KIvFkK3ZbYP |
|---|---|
| Name | 12-O-DEACETYL-12-EPI-SCALARIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H38O4 |
| InChI | InChI=1S/C25H38O4/c1-22(2)10-6-11-23(3)15(22)9-12-24(4)16-8-7-14-19(21(28)29-20(14)27)25(16,5)18(26)13-17(23)24/h7,15-19,21,26,28H,6,8-13H2,1-5H3/t15?,16-,17+,18+,19+,21+,23-,24-,25+/m0/s1 |
| InChIKey | ATVQOEWPZTUPDT-IZEIGIMZSA-N |
| Literature Reference Author | S.TSUKAMOTO,S.MIURA,R.W.M.VANSOEST,T.OHTA |
| Literature Reference Citation | J.NAT.PROD.,66,438(2003) |
| Literature Reference DOI | 10.1021/np020497l |
| Molecular Weight | 402.574 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSI4699 |