| SpectraBase Spectrum ID |
7lQVvimGI8q |
| Name |
(5R,8R)-6-Methyl-8.beta.-acetoxymethyl-9.alpha.-hydroxyergoline |
| Alternate Name(s) |
[(8beta,9alpha)-9-hydroxy-6-methylergolin-8-yl]methyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H22N2O3 |
| InChI |
InChI=1S/C18H22N2O3/c1-10(21)23-9-12-8-20(2)15-6-11-7-19-14-5-3-4-13(16(11)14)17(15)18(12)22/h3-5,7,12,15,17-19,22H,6,8-9H2,1-2H3/t12-,15-,17-,18-/m1/s1 |
| InChIKey |
VKSJWTXGNHOZOX-DGCUDZEOSA-N |
| Molecular Weight |
314.385 g/mol |
| SMILES |
O[C@]1([C@]2([C@@](Cc3c4c([nH]c3)cccc24)(N(C[C@@]1(COC(=O)C)[H])C)[H])[H])[H] |
| SPLASH |
splash10-0iki-0697000000-f504c9d7758242b4eed0 |
| Source of Spectrum |
H1-45-1500-6 |
| Wiley ID |
815804 |
