| SpectraBase Spectrum ID |
KEOKbHTELtQ |
| Name |
17-Norkauran-16-one, 2-(acetyloxy)-3-bromo-18-hydroxy-, (2.alpha.,3.beta.,4.alpha.)- |
| Alternate Name(s) |
(1R,4R,5R,6R,7R,9R,13S)-6-bromo-5-(hydroxymethyl)-5,9-dimethyl-14-oxotetracyclo[11.2.1.0(1,10).0(4,9)]hexadec-7-yl acetate
1H-2,10a-Ethanophenanthrene, 17-norkauran-16-one deriv.
ent-2.beta.-acetoxy-3.alpha.-bromo-19-hydroxy-17-norkauran-16-one |
| CAS Registry Number |
66549-96-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H31BrO4 |
| InChI |
InChI=1S/C21H31BrO4/c1-12(24)26-15-10-19(2)16(20(3,11-23)18(15)22)6-7-21-8-13(14(25)9-21)4-5-17(19)21/h13,15-18,23H,4-11H2,1-3H3/t13-,15+,16+,17?,18-,19-,20-,21+/m0/s1 |
| InChIKey |
ZSYODOZKCCJMDH-OVJAVQCXSA-N |
| Molecular Weight |
427.379 g/mol |
| SMILES |
OC[C@]1([C@]2([C@@](C3[C@]4(CC(=O)[C@@](CC3)(C4)[H])CC2)(C[C@]([C@@]1(Br)[H])(OC(=O)C)[H])C)[H])C |
| SPLASH |
splash10-0ap0-0791000000-19b1c744badafbceea45 |
| Source of Spectrum |
KC-1977-2322-0 |
| Wiley ID |
1379855 |
