| SpectraBase Spectrum ID |
9lTV8fiePUf |
| Name |
(5R,6R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-5,6-diol |
| Alternate Name(s) |
(5R,6R,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-5,6-diol |
| CAS Registry Number |
566-31-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H48O2 |
| InChI |
InChI=1S/C27H48O2/c1-18(2)9-8-10-19(3)21-11-12-22-20-17-24(28)27(29)15-7-6-14-26(27,5)23(20)13-16-25(21,22)4/h18-24,28-29H,6-17H2,1-5H3/t19-,20+,21-,22+,23+,24-,25-,26-,27+/m1/s1 |
| InChIKey |
HKHHYUSFWJROEJ-MYMLUCEJSA-N |
| Molecular Weight |
404.679 g/mol |
| SMILES |
O[C@@]1(C[C@]2([C@]3([C@](CC[C@@]2([C@@]2([C@@]1(CCCC2)O)C)[H])([C@](CC3)([C@@](CCCC(C)C)(C)[H])[H])C)[H])[H])[H] |
| SPLASH |
splash10-000i-0009000000-14a8a5a02cd7d7922b3a |
| Source of Spectrum |
I-65-2210-8 |
| Wiley ID |
1371584 |
