| SpectraBase Spectrum ID |
GPUhqhaO77y |
| Name |
(2R,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-ol |
| Alternate Name(s) |
(2R,5S,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-ol |
| CAS Registry Number |
604-17-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H48O |
| InChI |
InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-13-14-24-22-12-10-20-9-11-21(28)17-27(20,5)25(22)15-16-26(23,24)4/h18-25,28H,6-17H2,1-5H3/t19-,20-,21-,22+,23-,24+,25+,26-,27+/m1/s1 |
| InChIKey |
IANFNNPXOUVDGW-VBWRGJNHSA-N |
| Molecular Weight |
388.680 g/mol |
| SMILES |
O[C@]1(C[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(CC1)[H])[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H])C)[H] |
| SPLASH |
splash10-00di-0009000000-e7d2e48dea0001c64d33 |
| Source of Spectrum |
KC-1986-1074-23 |
| Wiley ID |
1364193 |
