![Morpholine, 4-[(3.beta.)-3-hydroxy-20-methyl-21-oxopregn-5-en-21-yl]-](/api/spectrum/E3XRpKWWWQ5/structure.png?h=300&w=458 "Morpholine, 4-[(3.beta.)-3-hydroxy-20-methyl-21-oxopregn-5-en-21-yl]-")
| SpectraBase Compound ID | KgnARxWl7zq |
|---|---|
| InChI | InChI=1S/C26H41NO3/c1-17(24(29)27-12-14-30-15-13-27)21-6-7-22-20-5-4-18-16-19(28)8-10-25(18,2)23(20)9-11-26(21,22)3/h4,17,19-23,28H,5-16H2,1-3H3 |
| InChIKey | XNBYGHRPGCDZOC-UHFFFAOYSA-N |
| Mol Weight | 415.6 g/mol |
| Molecular Formula | C26H41NO3 |
| Exact Mass | 415.308644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E3XRpKWWWQ5 |
|---|---|
| Name | Morpholine, 4-[(3.beta.)-3-hydroxy-20-methyl-21-oxopregn-5-en-21-yl]- |
| CAS Registry Number | 55103-89-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H41NO3 |
| InChI | InChI=1S/C26H41NO3/c1-17(24(29)27-12-14-30-15-13-27)21-6-7-22-20-5-4-18-16-19(28)8-10-25(18,2)23(20)9-11-26(21,22)3/h4,17,19-23,28H,5-16H2,1-3H3 |
| InChIKey | XNBYGHRPGCDZOC-UHFFFAOYSA-N |
| Molecular Weight | 415.618 g/mol |
| SMILES | OC1CC=2C(C3C(C4C(C)(C(C(C(=O)N5CCOCC5)C)CC4)CC3)CC2)(C)CC1 |
| SPLASH | splash10-0007-6902100000-c8705c9546afa83c0a88 |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | 2-(10,13-dimethyl-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-1-morpholin-4-yl-propan-1-one 2-(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-1-(4-morpholinyl)-1-propanone 2-(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-1-morpholin-4-ylpropan-1-one 2-(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-1-morpholino-propan-1-one |
| Wiley ID | 1376062 |