| SpectraBase Compound ID | CVh2ToFsETO |
|---|---|
| InChI | InChI=1S/C18H21NO5/c1-19-9-18(20)17(4-3-12(21-2)6-16(17)19)13-7-15-14(22-10-23-15)5-11(13)8-24-18/h3-5,7,12,16,20H,6,8-10H2,1-2H3/t12?,16-,17?,18+/m1/s1 |
| InChIKey | YLWAQARRNQVEHD-ATNLNUCZSA-N |
| Mol Weight | 331.37 g/mol |
| Molecular Formula | C18H21NO5 |
| Exact Mass | 331.141973 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3OXLejWLu0y |
|---|---|
| Name | Tazettine |
| CAS Registry Number | 545-16-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H21NO5 |
| InChI | InChI=1S/C18H21NO5/c1-19-9-18(20)17(4-3-12(21-2)6-16(17)19)13-7-15-14(22-10-23-15)5-11(13)8-24-18/h3-5,7,12,16,20H,6,8-10H2,1-2H3/t12?,16-,17?,18+/m1/s1 |
| InChIKey | YLWAQARRNQVEHD-ATNLNUCZSA-N |
| Molecular Weight | 331.368 g/mol |
| SMILES | O[C@]12C3(c4c(cc5OCOc5c4)CO1)[C@@](CC(OC)C=C3)(N(C2)C)[H] |
| SPLASH | splash10-0fka-9343000000-7a188326e0ce42067270 |
| Source of Spectrum | C-87-4903-2 |
| Synonyms | (+)-Tazettine 3-Epitazettine 8H-[1,3]dioxolo[6,7][2]benzopyrano[3,4-c]indol-6a(3H)-ol, 4,4a,5,6-tetrahydro-3-methoxy-5-methyl-, (3S,4aS,6aR,13bS)- Tazettine, (3.alpha.)- Crivelline Criwelline Sekisanin Sekisanine Sekisanolin Sekisanoline Tazetine Tazettin Ungernin Ungernine [3S-(3.alpha.,4a.alpha.,6a.beta.,13bR*)]-4,4a,5,6-Tetrahydro-3-methoxy-5-methyl-8H-[1,3]dioxolo[6,7][2]benzopyrano[3,4-c]indol-6a(3H)-ol NSC 115495 NSC 652297 NSC 88419 |
| Wiley ID | 1328676 |