| SpectraBase Compound ID | LD6Y7rIiOXZ |
|---|---|
| InChI | InChI=1S/C41H51NO11/c1-42-21-38(22-47-2)17-16-28(49-4)41-25-19-39(46)29(50-5)20-40(32(35(41)42)33(51-6)34(38)41,31(25)36(39)52-37(45)24-10-8-7-9-11-24)53-30(44)15-13-23-12-14-26(43)27(18-23)48-3/h7-15,18,25,28-29,31-36,43,46H,16-17,19-22H2,1-6H3/b15-13+/t25-,28+,29+,31-,32+,33+,34-,35?,36-,38+,39+,40-,41+/m1/s1 |
| InChIKey | GMMATBOWVRDANZ-YSVGBAGKSA-N |
| Mol Weight | 733.9 g/mol |
| Molecular Formula | C41H51NO11 |
| Exact Mass | 733.346211 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1eJaQDrCiGU |
|---|---|
| Name | 8-DEACETYL-8-(4-HYDROXY-3-METHOXYCINNAMOYL)-DELPHININE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H51NO11 |
| InChI | InChI=1S/C41H51NO11/c1-42-21-38(22-47-2)17-16-28(49-4)41-25-19-39(46)29(50-5)20-40(32(35(41)42)33(51-6)34(38)41,31(25)36(39)52-37(45)24-10-8-7-9-11-24)53-30(44)15-13-23-12-14-26(43)27(18-23)48-3/h7-15,18,25,28-29,31-36,43,46H,16-17,19-22H2,1-6H3/b15-13+/t25-,28+,29+,31-,32+,33+,34-,35?,36-,38+,39+,40-,41+/m1/s1 |
| InChIKey | GMMATBOWVRDANZ-YSVGBAGKSA-N |
| Literature Reference Author | H.K.DESAI,B.P.HART,R.W.CALDWELL,J.HUANG,S.W.PELLETIER |
| Literature Reference Citation | J.NAT.PROD.,61,743(1998) |
| Literature Reference DOI | 10.1021/np970499j |
| Molecular Weight | 733.856 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP2170 |