![2-Azetidinone, 1-[(3.beta.,5.alpha.,20S)-20-(dimethylamino)-4-oxopregnan-3-yl]-3-(1-methylethyl)-, (3R)-](/api/spectrum/CIJN2RBCCW3/structure.png?h=300&w=458 "2-Azetidinone, 1-[(3.beta.,5.alpha.,20S)-20-(dimethylamino)-4-oxopregnan-3-yl]-3-(1-methylethyl)-, (3R)-")
| SpectraBase Compound ID | AQQ07rVDPqF |
|---|---|
| InChI | InChI=1S/C29H48N2O2/c1-17(2)20-16-31(27(20)33)25-13-15-29(5)23-12-14-28(4)21(18(3)30(6)7)10-11-22(28)19(23)8-9-24(29)26(25)32/h17-25H,8-16H2,1-7H3 |
| InChIKey | MHFGHEARXPBTQH-UHFFFAOYSA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C29H48N2O2 |
| Exact Mass | 456.371579 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CIJN2RBCCW3 |
|---|---|
| Name | 2-Azetidinone, 1-[(3.beta.,5.alpha.,20S)-20-(dimethylamino)-4-oxopregnan-3-yl]-3-(1-methylethyl)-, (3R)- |
| Alternate Name(s) | 20-(Dimethylamino)-3-(3-isopropyl-2-oxo-1-azetidinyl)pregnan-4-one 1-[17-[1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxidanylidene-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]-3-propan-2-yl-azetidin-2-one 1-[17-[1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxo-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]-3-isopropyl-azetidin-2-one 1-[17-[1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxo-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]-3-propan-2-yl-2-azetidinone 1-[17-[1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxo-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]-3-propan-2-ylazetidin-2-one 1-[17-[1-(dimethylamino)ethyl]-4-keto-10,13-dimethyl-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]-3-isopropyl-azetidin-2-one 2-Azetidinone, 1-[20.alpha.-(dimethylamino)-4-oxo-5.alpha.-pregnan-3.beta.-yl]-3-isopropyl-, (3R)- Pachystermine A |
| CAS Registry Number | 6156-99-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H48N2O2 |
| InChI | InChI=1S/C29H48N2O2/c1-17(2)20-16-31(27(20)33)25-13-15-29(5)23-12-14-28(4)21(18(3)30(6)7)10-11-22(28)19(23)8-9-24(29)26(25)32/h17-25H,8-16H2,1-7H3 |
| InChIKey | MHFGHEARXPBTQH-UHFFFAOYSA-N |
| Molecular Weight | 456.715 g/mol |
| SMILES | CC12C3C(C4C(CC3)(C)C(C(N(C)C)C)CC4)CCC2C(=O)C(CC1)N1C(=O)C(C1)C(C)C |
| SPLASH | splash10-052f-4005900000-b9a72377400b2addd924 |
| Source of Spectrum | T-67-4846-0 |
| Wiley ID | 61062 |