| SpectraBase Spectrum ID |
7ZlMySn1FlP |
| Name |
(23S)-23H-5.alpha.-isocalystanol |
| Alternate Name(s) |
(2S,5S,15R)-2,15-dimethyl-14-[(2R)-1-[2-methyl-3-(propan-2-yl)cycloprop-2-en-1-yl]propan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-ol |
| CAS Registry Number |
116972-93-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H48O |
| InChI |
InChI=1S/C29H48O/c1-17(2)27-19(4)23(27)15-18(3)24-9-10-25-22-8-7-20-16-21(30)11-13-28(20,5)26(22)12-14-29(24,25)6/h17-18,20-26,30H,7-16H2,1-6H3/t18-,20?,21+,22?,23?,24?,25?,26?,28+,29-/m1/s1 |
| InChIKey |
XMKPXGGZJIEBEJ-OSGFZZFGSA-N |
| Molecular Weight |
412.702 g/mol |
| SMILES |
O[C@]1(CC[C@@]2(C3CC[C@@]4(C([C@@](CC5C(=C5C(C)C)C)(C)[H])CCC4C3CCC2C1)C)C)[H] |
| SPLASH |
splash10-0002-6940000000-961c5f4ba56710410316 |
| Source of Spectrum |
C-110-8128-10 |
| Wiley ID |
1374783 |
