| SpectraBase Compound ID | 9Wi6yP7xn70 |
|---|---|
| InChI | InChI=1S/C30H37NO5/c1-3-31-25-28(34)16-20-27(2)13-12-21(35-26(27)31)30(20,25)19-15-18-11-14-29(28,23(19)24(18)33)36-22(32)10-9-17-7-5-4-6-8-17/h4-10,18-21,23-26,33-34H,3,11-16H2,1-2H3/b10-9+/t18-,19+,20+,21-,23+,24-,25+,26?,27+,28-,29+,30+/m0/s1 |
| InChIKey | NFRGMHZBDJVKQB-ZXIZJNOZSA-N |
| Mol Weight | 491.6 g/mol |
| Molecular Formula | C30H37NO5 |
| Exact Mass | 491.267173 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4cqSnDfnCqE |
|---|---|
| Name | 8-O-CINNAMOYLGRACILINE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H37NO5 |
| InChI | InChI=1S/C30H37NO5/c1-3-31-25-28(34)16-20-27(2)13-12-21(35-26(27)31)30(20,25)19-15-18-11-14-29(28,23(19)24(18)33)36-22(32)10-9-17-7-5-4-6-8-17/h4-10,18-21,23-26,33-34H,3,11-16H2,1-2H3/b10-9+/t18-,19+,20+,21-,23+,24-,25+,26?,27+,28-,29+,30+/m0/s1 |
| InChIKey | NFRGMHZBDJVKQB-ZXIZJNOZSA-N |
| Literature Reference Author | G.D.L.FUENTE,J.A.GAVIN,R.D.ACOSTA,F.SANCHEZ-FERRANDO |
| Literature Reference Citation | PHYTOCHEM.,34,553(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)80044-S |
| Molecular Weight | 491.627 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU7395 |