| SpectraBase Compound ID | 21pfZ0m0EIs |
|---|---|
| InChI | InChI=1S/C30H32O9/c1-11-5-19(23-13(3)29(35)38-27(23)25-15(9-31)7-17(33)21(11)25)37-20-6-12(2)22-18(34)8-16(10-32)26(22)28-24(20)14(4)30(36)39-28/h7-8,14,19-20,23-28,31-32H,3,5-6,9-10H2,1-2,4H3/t14-,19+,20-,23-,24+,25+,26-,27+,28-/m1/s1 |
| InChIKey | AIGKJTXOWFMGLD-NVRLBRQWSA-N |
| Mol Weight | 536.6 g/mol |
| Molecular Formula | C30H32O9 |
| Exact Mass | 536.204633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IFGDEjJyqX0 |
|---|---|
| Name | LACTUCAIN-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H32O9 |
| InChI | InChI=1S/C30H32O9/c1-11-5-19(23-13(3)29(35)38-27(23)25-15(9-31)7-17(33)21(11)25)37-20-6-12(2)22-18(34)8-16(10-32)26(22)28-24(20)14(4)30(36)39-28/h7-8,14,19-20,23-28,31-32H,3,5-6,9-10H2,1-2,4H3/t14-,19+,20-,23-,24+,25+,26-,27+,28-/m1/s1 |
| InChIKey | AIGKJTXOWFMGLD-NVRLBRQWSA-N |
| Literature Reference Author | C.C.HOU,S.J.LIN,J.T.CHENG,F.L.HSU |
| Literature Reference Citation | J.NAT.PROD.,66,625(2003) |
| Literature Reference DOI | 10.1021/np0205349 |
| Molecular Weight | 536.579 g/mol |
| Solvent | ACETONE-D6:D2O |
| Source File Reference | UWSI7711 |