| SpectraBase Compound ID | 2TRhAXSDHB1 |
|---|---|
| InChI | InChI=1S/C31H41NO10/c1-8-13(2)25(36)42-19-11-29-21-18-10-28-9-14(3)20(24(31(28,29)38)41-17(6)35)23(40-16(5)34)30(28,37)26(29)32(18)12-27(21,7)22(19)39-15(4)33/h13,18-24,26,37-38H,3,8-12H2,1-2,4-7H3/t13?,18-,19+,20-,21+,22+,23+,24+,26-,27-,28-,29+,30+,31-/m0/s1 |
| InChIKey | MYJFNJPQVVCTMB-XXFGVQNASA-N |
| Mol Weight | 587.7 g/mol |
| Molecular Formula | C31H41NO10 |
| Exact Mass | 587.273047 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 35MAGyjWHVL |
|---|---|
| Name | 11,13-O-DIACETYLGLANDULINE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H41NO10 |
| InChI | InChI=1S/C31H41NO10/c1-8-13(2)25(36)42-19-11-29-21-18-10-28-9-14(3)20(24(31(28,29)38)41-17(6)35)23(40-16(5)34)30(28,37)26(29)32(18)12-27(21,7)22(19)39-15(4)33/h13,18-24,26,37-38H,3,8-12H2,1-2,4-7H3/t13?,18-,19+,20-,21+,22+,23+,24+,26-,27-,28-,29+,30+,31-/m0/s1 |
| InChIKey | MYJFNJPQVVCTMB-XXFGVQNASA-N |
| Literature Reference Author | L.RUIZ-MESIA,A.MADIAVEITIA,M.REINA,M.L.RODRIGUEZ,G.DELAFUENT E,W.RUIZ-MESIA |
| Literature Reference Citation | J.NAT.PROD.,65,496(2002) |
| Literature Reference DOI | 10.1021/np0103416 |
| Molecular Weight | 587.667 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI5567 |