| SpectraBase Compound ID | GAJ5Ag4XgNW |
|---|---|
| InChI | InChI=1S/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4+/t11-,14?,15?,18+/m0/s1 |
| InChIKey | HKODIGSRFALUTA-IWXSAOTQSA-N |
| Mol Weight | 335.4 g/mol |
| Molecular Formula | C18H25NO5 |
| Exact Mass | 335.173273 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8cdg2pmJSlz |
|---|---|
| Name | 12-Hydroxysenecionan-11,16-dione |
| CAS Registry Number | 480-79-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H25NO5 |
| InChI | InChI=1S/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4+/t11-,14?,15?,18+/m0/s1 |
| InChIKey | HKODIGSRFALUTA-IWXSAOTQSA-N |
| Molecular Weight | 335.400 g/mol |
| SMILES | O[C@@]1([C@](C\C(C(OC2C3C(=CCN3CC2)COC1=O)=O)=C/C)(C)[H])C |
| SPLASH | splash10-00y3-3910000000-63c603b20ddb1c115111 |
| Source of Spectrum | G4-64-11-4 |
| Synonyms | (15cis)-12-Hydroxysenecionan-11,16-dione (15E)-12-hydroxysenecionan-11,16-dione Aureine Inegerrimine Integerrimine Intergerrimine Pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-5,6-dimethyl(1,6)dioxacyclododecino(2,3,4-gh)- Senecionan-11,16-dione, 12-hydroxy- Senecionan-11,16-dione, 12-hydroxy-, (15E)- Senecionin Senecionine Squalidin Squalidine AI3-51771 BRN 0934445 CCRIS 4340 HSDB 3535 NSC 79540 NSC 89935 |
| Wiley ID | 1608755 |