![(17E)-21-[(EZ)-(2-Aminoethoxy)imino]-5.beta.-pregn-17-ene-3.beta.,14.beta.-diol](/api/spectrum/47V0gywUNnG/structure.png?h=300&w=458 "(17E)-21-[(EZ)-(2-Aminoethoxy)imino]-5.beta.-pregn-17-ene-3.beta.,14.beta.-diol")
| SpectraBase Compound ID | 994Rj1JLrSK |
|---|---|
| InChI | InChI=1S/C23H38N2O3/c1-21-9-6-18(26)15-17(21)3-4-20-19(21)7-10-22(2)16(5-11-23(20,22)27)8-13-25-28-14-12-24/h8,13,17-20,26-27H,3-7,9-12,14-15,24H2,1-2H3/b16-8+,25-13+/t17-,18+,19?,20?,21+,22-,23+/m1/s1 |
| InChIKey | WPDRPGKTYNPKGE-HCAFBJRRSA-N |
| Mol Weight | 390.6 g/mol |
| Molecular Formula | C23H38N2O3 |
| Exact Mass | 390.288243 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 47V0gywUNnG |
|---|---|
| Name | (17E)-21-[(EZ)-(2-Aminoethoxy)imino]-5.beta.-pregn-17-ene-3.beta.,14.beta.-diol |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H38N2O3 |
| InChI | InChI=1S/C23H38N2O3/c1-21-9-6-18(26)15-17(21)3-4-20-19(21)7-10-22(2)16(5-11-23(20,22)27)8-13-25-28-14-12-24/h8,13,17-20,26-27H,3-7,9-12,14-15,24H2,1-2H3/b16-8+,25-13+/t17-,18+,19?,20?,21+,22-,23+/m1/s1 |
| InChIKey | WPDRPGKTYNPKGE-HCAFBJRRSA-N |
| Molecular Weight | 390.568 g/mol |
| SMILES | NCCO\N=C\C=C\1[C@@]2([C@](CC1)(C1CC[C@@]3(C[C@](CC[C@@]3(C1CC2)C)(O)[H])[H])O)C |
| SPLASH | splash10-001i-9002000000-b6e53cbc8394e3864393 |
| Source of Spectrum | F2-43-2346-49 |
| Wiley ID | 1600712 |