| SpectraBase Spectrum ID |
9zjvgrel5rg |
| Name |
1H-Isoindole-1,3(2H)-dione, 2-[(3.beta.,25R)-3-hydroxycholest-5-en-26-yl]- |
| Alternate Name(s) |
Cholestane, 1H-isoindole-1,3(2H)-dione deriv.
(25R)-26-Phthalimido-5-cholesten-3.beta.-ol
2-[(3beta,25R)-3-hydroxycholest-5-en-27-yl]-1H-isoindole-1,3(2H)-dione |
| CAS Registry Number |
71472-92-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H49NO3 |
| InChI |
InChI=1S/C35H49NO3/c1-22(21-36-32(38)26-10-5-6-11-27(26)33(36)39)8-7-9-23(2)29-14-15-30-28-13-12-24-20-25(37)16-18-34(24,3)31(28)17-19-35(29,30)4/h5-6,10-12,22-23,25,28-31,37H,7-9,13-21H2,1-4H3/t22-,23-,25+,28+,29-,30+,31+,34+,35-/m1/s1 |
| InChIKey |
OPPZOWOQYDNVIJ-JZGKWJGOSA-N |
| Molecular Weight |
531.781 g/mol |
| SMILES |
O[C@]1(CC[C@@]2([C@]3(CC[C@@]4([C@@]([C@@](CCC[C@](CN5C(c6ccccc6C5=O)=O)(C)[H])(C)[H])(CC[C@]4([C@@]3(CC=C2C1)[H])[H])[H])C)[H])C)[H] |
| SPLASH |
splash10-03di-0971370000-239d768692748ab67c7b |
| Source of Spectrum |
K-112-2686-0 |
| Wiley ID |
1403501 |
![1H-Isoindole-1,3(2H)-dione, 2-[(3.beta.,25R)-3-hydroxycholest-5-en-26-yl]-](/api/spectrum/9zjvgrel5rg/structure.png?h=300&w=458 "1H-Isoindole-1,3(2H)-dione, 2-[(3.beta.,25R)-3-hydroxycholest-5-en-26-yl]-")
