| SpectraBase Compound ID | L8zrtcPKayR |
|---|---|
| InChI | InChI=1S/C28H47ClN2O7/c1-5-6-7-8-10-13-25(37-3)14-11-9-12-15-27(35)31(2)21-22(19-29)16-23(32)17-26(34)30-20-24(33)18-28(36)38-4/h9,11,19,24-25,33H,5-8,10,12-18,20-21H2,1-4H3,(H,30,34)/b11-9+,22-19+/t24-,25+/m1/s1 |
| InChIKey | FGRVZQUFZGRBFK-HMDSDUGSSA-N |
| Mol Weight | 559.1 g/mol |
| Molecular Formula | C28H47ClN2O7 |
| Exact Mass | 558.30718 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hs0Ja8uuSk0 |
|---|---|
| Name | MALYNGAMIDE_3 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H47ClN2O7 |
| InChI | InChI=1S/C28H47ClN2O7/c1-5-6-7-8-10-13-25(37-3)14-11-9-12-15-27(35)31(2)21-22(19-29)16-23(32)17-26(34)30-20-24(33)18-28(36)38-4/h9,11,19,24-25,33H,5-8,10,12-18,20-21H2,1-4H3,(H,30,34)/b11-9+,22-19+/t24-,25+/m1/s1 |
| InChIKey | FGRVZQUFZGRBFK-HMDSDUGSSA-N |
| Literature Reference Author | S.P.GUNASEKERA,C.S.OWLE,R.MONTASER,H.LUESCH,V.J.PAUL |
| Literature Reference Citation | J.NAT.PROD.,74,871(2011) |
| Literature Reference DOI | 10.1021/np1008015 |
| Molecular Weight | 559.143 g/mol |
| Sample ID | 38019 |
| Solvent | CDCl3 |