| SpectraBase Compound ID | GqYvleK4CzC |
|---|---|
| InChI | InChI=1S/C32H44N2O9/c1-6-34-27-31-18-13-17-20(39-2)14-30(37,22(18)23(17)41-4)32(27,38)25(42-5)24(31)29(28(34)36,12-11-21(31)40-3)15-43-26(35)16-9-7-8-10-19(16)33/h7-10,17-18,20-25,27,37-38H,6,11-15,33H2,1-5H3/t17-,18?,20+,21?,22?,23+,24?,25+,27?,29+,30-,31+,32+/m1/s1 |
| InChIKey | ABHLLCOMIOJWIA-TUKWWVDZSA-N |
| Mol Weight | 600.7 g/mol |
| Molecular Formula | C32H44N2O9 |
| Exact Mass | 600.304681 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8gYNNI5oaaZ |
|---|---|
| Name | 19-OXO-ANTHRANOYLLYCOCTONINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H44N2O9 |
| InChI | InChI=1S/C32H44N2O9/c1-6-34-27-31-18-13-17-20(39-2)14-30(37,22(18)23(17)41-4)32(27,38)25(42-5)24(31)29(28(34)36,12-11-21(31)40-3)15-43-26(35)16-9-7-8-10-19(16)33/h7-10,17-18,20-25,27,37-38H,6,11-15,33H2,1-5H3/t17-,18?,20+,21?,22?,23+,24?,25+,27?,29+,30-,31+,32+/m1/s1 |
| InChIKey | ABHLLCOMIOJWIA-TUKWWVDZSA-N |
| Literature Reference Author | X.LIANG,S.A.ROSS,Y.R.SOHNI,H.M.SAYED,H.K.DESAI,B.S.JOSHI,S.W .PELLETIER |
| Literature Reference Citation | J.NAT.PROD.,54,1283(1991) |
| Literature Reference DOI | 10.1021/np50077a007 |
| Molecular Weight | 600.709 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS807 |