| SpectraBase Compound ID | 5Bto3Jw4qyU |
|---|---|
| InChI | InChI=1S/C25H26Cl2O5/c1-13-5-4-6-14-9-15-17(31-12-14)10-16-19(20(15)28)22(30)24(27)11-18(26)23(2,3)32-25(24,8-7-13)21(16)29/h6-7,10,18,28H,4-5,8-9,11-12H2,1-3H3/b13-7+,14-6-/t18-,24+,25+/m1/s1 |
| InChIKey | CGYXUANFCZTNCN-SYDPDMOYSA-N |
| Mol Weight | 477.38 g/mol |
| Molecular Formula | C25H26Cl2O5 |
| Exact Mass | 476.115729 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2PNcrgYmbrE |
|---|---|
| Name | NAPYRADIOMYCIN_SR |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H26Cl2O5 |
| InChI | InChI=1S/C25H26Cl2O5/c1-13-5-4-6-14-9-15-17(31-12-14)10-16-19(20(15)28)22(30)24(27)11-18(26)23(2,3)32-25(24,8-7-13)21(16)29/h6-7,10,18,28H,4-5,8-9,11-12H2,1-3H3/b13-7+,14-6-/t18-,24+,25+/m1/s1 |
| InChIKey | CGYXUANFCZTNCN-SYDPDMOYSA-N |
| Literature Reference Author | K.MOTOHASHI,M.SUE,K.FURIHATA,S.ITO,H.SETO |
| Literature Reference Citation | J.NAT.PROD.,71,595(2008) |
| Literature Reference DOI | 10.1021/np070575a |
| Molecular Weight | 477.384 g/mol |
| Sample ID | 27616 |
| Solvent | CDCl3 |