| SpectraBase Spectrum ID |
6N3XEbzonVD |
| Name |
Benzenesulfonic acid, 4-methyl-, [(3.beta.,5.alpha.,17.alpha.)-3-hydroxy-18-iodopregnan-20-ylidene]hyd razide |
| Alternate Name(s) |
Pregnane, benzenesulfonic acid deriv.
18-iodo-20-tosylhydrazino-5.alpha.,17.beta.-H-pregnan-3-ol
N'-[(3beta,5alpha,17alpha)-3-hydroxy-18-iodopregnan-20-ylidene]-4-methylbenzenesulfonohydrazide |
| CAS Registry Number |
69063-97-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H41IN2O3S |
| InChI |
InChI=1S/C28H41IN2O3S/c1-18-4-7-22(8-5-18)35(33,34)31-30-19(2)24-10-11-26-23-9-6-20-16-21(32)12-14-27(20,3)25(23)13-15-28(24,26)17-29/h4-5,7-8,20-21,23-26,31-32H,6,9-17H2,1-3H3/b30-19-/t20-,21-,23+,24-,25-,26-,27-,28-/m0/s1 |
| InChIKey |
LNGGNXBVLVWBEL-PHNIXCIDSA-N |
| Molecular Weight |
612.611 g/mol |
| SMILES |
N(S(c1ccc(cc1)C)(=O)=O)\N=C/([C@]1([C@]2(CC[C@@]3([C@]4(CC[C@@](C[C@@]4(CC[C@]3([C@@]2(CC1)[H])[H])[H])(O)[H])C)[H])CI)[H])C |
| SPLASH |
splash10-014i-2009000000-eafa222f6534c34d2ea5 |
| Source of Spectrum |
F-34-1535-0 |
| Wiley ID |
1411031 |
![Benzenesulfonic acid, 4-methyl-, [(3.beta.,5.alpha.,17.alpha.)-3-hydroxy-18-iodopregnan-20-ylidene]hyd razide](/api/spectrum/6N3XEbzonVD/structure.png?h=300&w=458 "Benzenesulfonic acid, 4-methyl-, [(3.beta.,5.alpha.,17.alpha.)-3-hydroxy-18-iodopregnan-20-ylidene]hyd razide")
