| SpectraBase Spectrum ID |
4bgDpUIP55j |
| Name |
(17R)-17-Ethynyl-3-methoxy-1,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[A]phenanthren-17-ol |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.208930140 u |
| Formula |
C22H28O2 |
| InChI |
InChI=1S/C22H28O2/c1-5-22(23)11-9-19-17-7-6-15-13-16(24-4)12-14(2)20(15)18(17)8-10-21(19,22)3/h1,12-13,17-19,23H,6-11H2,2-4H3/t17?,18?,19?,21?,22-/m0/s1 |
| InChIKey |
SDXFYMDYTAJWRS-KMXFLUGXSA-N |
| Molecular Weight |
324.464 g/mol |
| SMILES |
C12(C(C3CCC4=C(C3CC2)C(=CC(OC)=C4)C)CC[C@]1(C#C)O)C |
![(17R)-17-ethynyl-3-methoxy-1,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol](/api/spectrum/4bgDpUIP55j/structure.png?h=300&w=458 "(17R)-17-ethynyl-3-methoxy-1,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol")
