| SpectraBase Compound ID | 6A6r10ECXyz |
|---|---|
| InChI | InChI=1S/C22H36O5/c1-15(2)22-11-9-20(5,25)14-18(24)13-16(3)7-8-19(26-17(4)23)21(6,27-22)10-12-22/h9,11,15-16,19,25H,7-8,10,12-14H2,1-6H3/b11-9+/t16-,19+,20-,21-,22-/m0/s1 |
| InChIKey | IUFPYOKJDZVLEN-MDELZEAXSA-N |
| Mol Weight | 380.5 g/mol |
| Molecular Formula | C22H36O5 |
| Exact Mass | 380.256274 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 71AKiFPgKFi |
|---|---|
| Name | CRASSARINE-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H36O5 |
| InChI | InChI=1S/C22H36O5/c1-15(2)22-11-9-20(5,25)14-18(24)13-16(3)7-8-19(26-17(4)23)21(6,27-22)10-12-22/h9,11,15-16,19,25H,7-8,10,12-14H2,1-6H3/b11-9+/t16-,19+,20-,21-,22-/m0/s1 |
| InChIKey | IUFPYOKJDZVLEN-MDELZEAXSA-N |
| Literature Reference Author | C.H.CHAO,K.J.CHOU,C.Y.HUANG,Z.H.WEN,C.H.HSU,Y.C.WU,C.F.DAI,J .H.SHEU |
| Literature Reference Citation | MAR.DRUGS,9,1955(2011) |
| Literature Reference DOI | 10.3390/md9101955 |
| Molecular Weight | 380.525 g/mol |
| Source File Reference | UWBT7054 |