| SpectraBase Compound ID | FRPGDsKQS13 |
|---|---|
| InChI | InChI=1S/C21H35NO/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,13,15-19,23H,5-12,22H2,1-3H3 |
| InChIKey | FLEBIYNUTZNISZ-UHFFFAOYSA-N |
| Mol Weight | 317.5 g/mol |
| Molecular Formula | C21H35NO |
| Exact Mass | 317.271865 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HwX3dSt2J5K |
|---|---|
| Name | Pregn-5-en-3-ol, 20-amino-, (3.beta.,20S)- |
| Alternate Name(s) | 20-Aminopregn-5-en-3-ol 17-(1-aminoethyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol 17-(1-azanylethyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol Holafebrine Pregn-5-en-3.beta.-ol, 20.alpha.-amino- |
| CAS Registry Number | 5035-10-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H35NO |
| InChI | InChI=1S/C21H35NO/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,13,15-19,23H,5-12,22H2,1-3H3 |
| InChIKey | FLEBIYNUTZNISZ-UHFFFAOYSA-N |
| Molecular Weight | 317.517 g/mol |
| SMILES | NC(C1CCC2C1(CCC1C2CC=C2CC(O)CCC12C)C)C |
| SPLASH | splash10-0006-9100000000-f145e976f54e0608f6fc |
| Source of Spectrum | W5-28548-0-0 |
| Wiley ID | 1317882 |