| SpectraBase Compound ID | 1gysTPJcdbV |
|---|---|
| InChI | InChI=1S/C20H32O4/c1-17-7-4-8-18(2,16(22)24-3)13(17)5-9-19-11-15(21)20(23,12-19)10-6-14(17)19/h13-15,21,23H,4-12H2,1-3H3/t13-,14-,15+,17+,18-,19+,20-/m1/s1 |
| InChIKey | LGRNRRXFIGVXKS-CTQHUPSLSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C20H32O4 |
| Exact Mass | 336.23006 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AssBJS6NDO6 |
|---|---|
| Name | 17-Norkauran-18-oic acid, 13,16-dihydroxy-, methyl ester, (4.alpha.,16.alpha.)- |
| CAS Registry Number | 59599-30-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32O4 |
| InChI | InChI=1S/C20H32O4/c1-17-7-4-8-18(2,16(22)24-3)13(17)5-9-19-11-15(21)20(23,12-19)10-6-14(17)19/h13-15,21,23H,4-12H2,1-3H3/t13-,14-,15+,17+,18-,19+,20-/m1/s1 |
| InChIKey | LGRNRRXFIGVXKS-CTQHUPSLSA-N |
| Molecular Weight | 336.472 g/mol |
| SMILES | O[C@]12CC[C@]3([C@](C[C@@]2(O)[H])(CC[C@]2([C@@](CCC[C@]32C)(C(=O)OC)C)[H])C1)[H] |
| SPLASH | splash10-0006-0090000000-8d1ad47f93c7ce92115f |
| Source of Spectrum | F-32-374-0 |
| Synonyms | 1H-2,10a-Ethanophenanthrene, 17-norkauran-18-oic acid deriv. 17-Norkauran-18-oic acid, 13,16-dihydroxy-, methyl ester, (4.alpha.,8.beta.,13.beta.,16.alpha.)- 17-Norkauran-18-oic acid, 13,16-dihydroxy-, methyl ester, (4.alpha.,8.beta.,13.beta.,16.beta.)- 17-nor-8.beta.,13.beta.-kauran-18-oic acid, 13,16.beta.-dihydroxy-, methyl ester Methyl (1S,4R,5R,9R,10S,13R,14S)-13,14-dihydroxy-5,9-dimethyltetracyclo[11.2.1.0(1,10).0(4,9)]hexadecane-5-carboxylate Methyl ent-13,16.alpha.-dihydroxy-17-nor-beyeran-19-oate Methyl-ent-13,16.alpha.-dihydroxy-17-nor-kauran-19-oate Methyl-ent-13,16.beta.-dihydroxy-17-nor-beyeran-19-oate |
| Wiley ID | 1332541 |