| SpectraBase Spectrum ID |
BjcoGqClqRo |
| Name |
3.beta.-acetoxymethyl-24-methyl-a-hor-5.alpha.-cholest-22-ene |
| Alternate Name(s) |
{(1S,3aR,3bS,5aR,6R,8aS,8bS,10aS)-3a,5a-dimethyl-6-[(1R,2E)-1,4,5-trimethyl-2-hexenyl]hexadecahydrodicyclopenta[a,f]naphthalen-1-yl}methyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H50O2 |
| InChI |
InChI=1S/C30H50O2/c1-19(2)20(3)8-9-21(4)25-12-13-27-24-10-11-26-23(18-32-22(5)31)14-16-30(26,7)28(24)15-17-29(25,27)6/h8-9,19-21,23-28H,10-18H2,1-7H3/b9-8+/t20?,21-,23-,24+,25-,26+,27+,28+,29-,30+/m1/s1 |
| InChIKey |
FKPWBLPQJCETBX-FTSGGABYSA-N |
| Molecular Weight |
442.728 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](\C=C\C(C(C)C)C)(C)[H])[H])[H])([H])CC[C@]2([C@@](COC(=O)C)(CC1)[H])[H])[H])C |
| SPLASH |
splash10-052f-0079400000-0e065530c04ba9925699 |
| Source of Spectrum |
KC-74-2383-5 |
| Wiley ID |
1385560 |
