| SpectraBase Compound ID | GXQTDZegjiM |
|---|---|
| InChI | InChI=1S/C29H37NO3/c1-19-12-13-22-23(11-8-15-28(22,2)3)29(19,4)18-21-26(32)24(17-25(31)27(21)33)30-16-14-20-9-6-5-7-10-20/h5-7,9-10,13,17,19,23,30,33H,8,11-12,14-16,18H2,1-4H3/t19-,23+,29+/m0/s1 |
| InChIKey | XPBBMGKNBSHXLB-VNHZXFAYSA-N |
| Mol Weight | 447.6 g/mol |
| Molecular Formula | C29H37NO3 |
| Exact Mass | 447.277344 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ffaO0ptGqn |
|---|---|
| Name | NAKIJIQUINONE_P |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H37NO3 |
| InChI | InChI=1S/C29H37NO3/c1-19-12-13-22-23(11-8-15-28(22,2)3)29(19,4)18-21-26(32)24(17-25(31)27(21)33)30-16-14-20-9-6-5-7-10-20/h5-7,9-10,13,17,19,23,30,33H,8,11-12,14-16,18H2,1-4H3/t19-,23+,29+/m0/s1 |
| InChIKey | XPBBMGKNBSHXLB-VNHZXFAYSA-N |
| Literature Reference Author | Y.TAKAHASHI,M.USHIO,T.KUBOTA,S.YAMAMOTO,J.FROMONT,J.KOBAYASH I |
| Literature Reference Citation | J.NAT.PROD.,73,467(2010) |
| Literature Reference DOI | 10.1021/np900470e |
| Molecular Weight | 447.618 g/mol |
| Sample ID | 35117 |
| Solvent | CDCl3 |