| SpectraBase Spectrum ID |
HCzD4geXFCF |
| Name |
[6-3H]-(25R)-24-Methylene-27-methyl-3.alpha.,5-cyclocholestan-6.alpha.-ol |
| Alternate Name(s) |
6-Tritium-(25R)-24-methylene-27-methyl-3.alpha.,5-cyclocholestan-6.alpha.-ol |
| Comments |
Original formula: C29H47[3H]O; Note: The molecular formula of the structure shown is C29H47TO - which differs from the formula reported for the mass spectrum (C29H47[3H]O) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H48O |
| InChI |
InChI=1S/C29H48O/c1-7-18(2)19(3)8-9-20(4)23-10-11-24-22-16-26(30)29-17-21(29)12-15-28(29,6)25(22)13-14-27(23,24)5/h18,20-26,30H,3,7-17H2,1-2,4-6H3/t18-,20-,21+,22+,23-,24+,25+,26+,27-,28-,29?/m1/s1/i26T |
| InChIKey |
RZNHKPPKHPFDLU-MPQDPWDLSA-N |
| Molecular Weight |
414.710 g/mol |
| SMILES |
O[C@@]1(C23[C@@]([C@]4(CC[C@]5([C@]([C@@]4(C1)[H])(CC[C@@]5([C@@](CCC(=C)[C@@](CC)(C)[H])(C)[H])[H])[H])C)[H])(CC[C@]3(C2)[H])C)[3H] |
| SPLASH |
splash10-06r2-3094000000-2eabb15dced9452fcb18 |
| Source of Spectrum |
C-108-8241-43 |
| Wiley ID |
1374866 |
![[6-3H]-(25R)-24-Methylene-27-methyl-3.alpha.,5-cyclocholestan-6.alpha.-ol](/api/spectrum/HCzD4geXFCF/structure.png?h=300&w=458 "[6-3H]-(25R)-24-Methylene-27-methyl-3.alpha.,5-cyclocholestan-6.alpha.-ol")
