| SpectraBase Spectrum ID |
9s9i95gETTy |
| Name |
Isotetrahydro-histrionicotoxin |
| Alternate Name(s) |
2-(1',3'-Butadien-1'-yl)-6-spiro[2''-(3''',4'''-pentadien-1'''-yl)-3''-hydroxycyclohexano]-piperidine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H29NO |
| InChI |
InChI=1S/C19H29NO/c1-3-5-7-10-16-11-8-14-19(20-16)15-9-13-18(21)17(19)12-6-4-2/h3-7,12,16-18,20-21H,1-2,8-11,13-15H2/b7-5+,12-6+/t16?,17-,18-,19-/m1/s1 |
| InChIKey |
DQLZNDOWVBOLDA-PURQKMQYSA-N |
| Molecular Weight |
287.447 g/mol |
| SMILES |
N1C(CCC[C@@]11[C@@]([C@@](CCC1)(O)[H])(\C=C\C=C)[H])C\C=C\C=C |
| SPLASH |
splash10-006t-7190000000-649c0ae76286586c03d1 |
| Source of Spectrum |
X2-68-1556-1575 |
| Wiley ID |
1610164 |
