| SpectraBase Compound ID | B0ZH8frsPc0 |
|---|---|
| InChI | InChI=1S/C38H53NO12/c1-10-39-17-36(18-43-4)27(49-19(2)40)15-28(47-8)38-23-14-22-26(46-7)16-37(51-20(3)41,30(34(38)39)32(48-9)33(36)38)29(23)31(22)50-35(42)21-11-12-24(44-5)25(13-21)45-6/h11-13,22-23,26-34H,10,14-18H2,1-9H3/t22-,23-,26+,27-,28+,29-,30+,31+,32+,33-,34?,36+,37-,38+/m1/s1 |
| InChIKey | GMZGXCGNUUNWTG-ABBDMFBISA-N |
| Mol Weight | 715.8 g/mol |
| Molecular Formula | C38H53NO12 |
| Exact Mass | 715.356776 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 225QDKm9S5D |
|---|---|
| Name | 3,8-DIACETYLFALCONERINE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H53NO12 |
| InChI | InChI=1S/C38H53NO12/c1-10-39-17-36(18-43-4)27(49-19(2)40)15-28(47-8)38-23-14-22-26(46-7)16-37(51-20(3)41,30(34(38)39)32(48-9)33(36)38)29(23)31(22)50-35(42)21-11-12-24(44-5)25(13-21)45-6/h11-13,22-23,26-34H,10,14-18H2,1-9H3/t22-,23-,26+,27-,28+,29-,30+,31+,32+,33-,34?,36+,37-,38+/m1/s1 |
| InChIKey | GMZGXCGNUUNWTG-ABBDMFBISA-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 | 715.838 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP2173 |