| SpectraBase Compound ID | Dn8QOwGj1Io |
|---|---|
| InChI | InChI=1S/C19H28O3/c1-12-15-13(20)9-17-6-5-16(2,10-17)4-3-14(17)18(15)7-8-19(12,21)22-11-18/h5-6,12-15,20-21H,3-4,7-11H2,1-2H3/t12-,13+,14+,15-,16+,17+,18+,19+/m1/s1 |
| InChIKey | GQIQHIKIDCFTCU-HKQJUHHRSA-N |
| Mol Weight | 304.43 g/mol |
| Molecular Formula | C19H28O3 |
| Exact Mass | 304.203845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9R3fVtKgaRN |
|---|---|
| Name | AGALLOCHIN-I;3-BETA,20-EPOXY-3-ALPHA,6-ALPHA-DIHYDROXY-18-NOR-BEYER-15-ENE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C19H28O3 |
| InChI | InChI=1S/C19H28O3/c1-12-15-13(20)9-17-6-5-16(2,10-17)4-3-14(17)18(15)7-8-19(12,21)22-11-18/h5-6,12-15,20-21H,3-4,7-11H2,1-2H3/t12-,13+,14+,15-,16+,17+,18+,19+/m1/s1 |
| InChIKey | GQIQHIKIDCFTCU-HKQJUHHRSA-N |
| Literature Reference Author | A.S.R.ANJAEYULU,V.L.RAO,K.SREEDHAR |
| Literature Reference Citation | J.NAT.PROD.,65,382(2002) |
| Literature Reference DOI | 10.1021/np010262u |
| Molecular Weight | 304.430 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI4087 |