| SpectraBase Compound ID | Idv7YslOS5e |
|---|---|
| InChI | InChI=1S/C26H35NO4/c1-25-14-12-20-18(8-11-22(28)27-23(29)13-15-26(20,27)2)19(25)9-10-21(25)31-24(30)16-17-6-4-3-5-7-17/h3-7,18-21,23,29H,8-16H2,1-2H3/t18?,19?,20?,21-,23-,25-,26+/m0/s1 |
| InChIKey | VBUFYYQOJXISIK-MNSGVSGNSA-N |
| Mol Weight | 425.6 g/mol |
| Molecular Formula | C26H35NO4 |
| Exact Mass | 425.256609 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5Gqp77G9rs |
|---|---|
| Name | 3-.beta.,17.beta.-Dihydroxy-5-aza-A-nor-B-homoandrostan-6-one Benzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H35NO4 |
| InChI | InChI=1S/C26H35NO4/c1-25-14-12-20-18(8-11-22(28)27-23(29)13-15-26(20,27)2)19(25)9-10-21(25)31-24(30)16-17-6-4-3-5-7-17/h3-7,18-21,23,29H,8-16H2,1-2H3/t18?,19?,20?,21-,23-,25-,26+/m0/s1 |
| InChIKey | VBUFYYQOJXISIK-MNSGVSGNSA-N |
| Molecular Weight | 425.569 g/mol |
| SMILES | O[C@@]1(N2[C@@](C3C(C4CC[C@@]([C@]4(CC3)C)(OC(=O)Cc3ccccc3)[H])CCC2=O)(CC1)C)[H] |
| SPLASH | splash10-052f-8709000000-a59572b2abefcb40e4f2 |
| Source of Spectrum | J-57-4120-24 |
| Wiley ID | 1379693 |