| SpectraBase Compound ID | 8FUCrXJ0H4r |
|---|---|
| InChI | InChI=1S/C20H32O5/c1-17(2,24)20(25)9-6-13-12(11-20)14(21)10-15-18(13,3)7-5-8-19(15,4)16(22)23/h11,13-15,21,24-25H,5-10H2,1-4H3,(H,22,23)/t13-,14+,15+,18+,19+,20+/m0/s1 |
| InChIKey | RSKXVFWGGCGVMM-AZBDUMLBSA-N |
| Mol Weight | 352.5 g/mol |
| Molecular Formula | C20H32O5 |
| Exact Mass | 352.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JA1zxlcNUIB |
|---|---|
| Name | 7-ALPHA,13-BETA,15-TRIHYDROXYABIET-8(14)-EN-18-OIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H32O5 |
| InChI | InChI=1S/C20H32O5/c1-17(2,24)20(25)9-6-13-12(11-20)14(21)10-15-18(13,3)7-5-8-19(15,4)16(22)23/h11,13-15,21,24-25H,5-10H2,1-4H3,(H,22,23)/t13-,14+,15+,18+,19+,20+/m0/s1 |
| InChIKey | RSKXVFWGGCGVMM-AZBDUMLBSA-N |
| Literature Reference Author | H.OHTSU,R.TANAKA,Y.IN,S.MATSUNAGA,H.TOKUDA,H.NISHINO |
| Literature Reference Citation | CAN.J.CHEM.,78,31(2000) |
| Literature Reference DOI | 10.1139/cjc-78-1-31 |
| Molecular Weight | 352.471 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI541 |