| SpectraBase Spectrum ID |
I4IAw9r667Y |
| Name |
(2beta,3beta,5beta)-2,3,14-trihydroxycholest-7-en-6-one |
| CAS Registry Number |
7698-67-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H44O4 |
| InChI |
InChI=1S/C27H44O4/c1-16(2)7-6-8-17(3)18-10-12-27(31)20-13-22(28)21-14-23(29)24(30)15-25(21,4)19(20)9-11-26(18,27)5/h13,16-19,21,23-24,29-31H,6-12,14-15H2,1-5H3/t17-,18-,19+,21-,23-,24+,25-,26-,27?/m1/s1 |
| InChIKey |
QPGHAYOKHPQLQO-JGSSKANISA-N |
| Molecular Weight |
432.645 g/mol |
| SMILES |
O[C@]1(C[C@@]2([C@]3(CC[C@]4(C(C3=CC([C@]2(C[C@]1(O)[H])[H])=O)(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])O)C)[H])C)[H] |
| SPLASH |
splash10-0f89-0089100000-ad85efc338d0c1b5782c |
| Source of Spectrum |
W5-34940-30596-30596 |
| Synonyms |
Cholest-7-en-6-one, 2,3,14-trihydroxy-, (2.beta.,3.beta.,5.alpha.)-
2,3,14-Trihydroxycholest-7-en-6-one
Cholest-7-en-6-one, 2,3,14-trihydroxy-, (2beta,3beta,5beta)-
(2beta,3beta,5alpha)-2,3,14-trihydroxycholest-7-en-6-one
Cholest-7-en-6-one, 2,3,14-trihydroxy-, (2beta,3beta,5alpha)- |
| Wiley ID |
1382457 |
