| SpectraBase Spectrum ID |
GFEZo8qWLZ7 |
| Name |
Methyl 3.beta.-acetoxy-16-carbamoyl-16,17-seco-5.alpha.-an-drostan-17-oate |
| Alternate Name(s) |
Methyl (2S,4aS,4bS,7S,8aS,10aR)-7-(acetyloxy)-1-(2-amino-2-oxoethyl)-2,4b-dimethyltetradecahydro-2-phenanthrenecarboxylate |
| CAS Registry Number |
85639-95-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H35NO5 |
| InChI |
InChI=1S/C22H35NO5/c1-13(24)28-15-7-9-21(2)14(11-15)5-6-16-17(21)8-10-22(3,20(26)27-4)18(16)12-19(23)25/h14-18H,5-12H2,1-4H3,(H2,23,25)/t14-,15-,16+,17-,18?,21-,22-/m0/s1 |
| InChIKey |
UGWHKAIHQPENIO-IPRWWCNFSA-N |
| Molecular Weight |
393.524 g/mol |
| SMILES |
NC(CC1[C@]2([C@@]([C@@]3([C@](C[C@@](OC(=O)C)(CC3)[H])(CC2)[H])C)(CC[C@@]1(C(=O)OC)C)[H])[H])=O |
| SPLASH |
splash10-0006-0019000000-aedf72f144a9393f2beb |
| Source of Spectrum |
AJ-56-356-4 |
| Wiley ID |
1366300 |
