| SpectraBase Spectrum ID |
7P9fcEFOwnA |
| Name |
4,4-Dimethyl-4-hydroxy-2-iodo-3-nor-2,4-secocholest-5-ene formate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H47IO3 |
| InChI |
InChI=1S/C29H47IO3/c1-19(2)9-8-10-20(3)21-11-12-22-26-23(13-14-28(21,22)6)29(7,15-16-30)25(17-24(26)32)27(4,5)33-18-31/h17-23,26H,8-16H2,1-7H3/t20-,21-,22+,23?,26?,28-,29-/m1/s1 |
| InChIKey |
RQQJBUMUJVLSHH-KHKVTCMOSA-N |
| Molecular Weight |
570.596 g/mol |
| SMILES |
C=1([C@@](C2C([C@]3([C@]([C@]([C@@](CCCC(C)C)(C)[H])([H])CC3)(C)CC2)[H])C(C1)=O)(CCI)C)C(OC=O)(C)C |
| SPLASH |
splash10-0006-9000030000-b713ef4c38af9d8104b7 |
| Source of Spectrum |
KC-1992-3121-5 |
| Wiley ID |
777338 |
