| SpectraBase Spectrum ID |
4kfX2xv5QsI |
| Name |
(2R,3R,4S,5R)-2-[(8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-((R)-1,4,5-trimethyl-heptyl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yloxy]-tetrahydro-pyran- |
| Alternate Name(s) |
24,26-Dimethylcholest-5-en-3.beta.-O-xylopyranoside
3,4,5-triol
Aplisterol-3-O-.beta.-D-xylopyranoside |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C34H58O5 |
| InChI |
InChI=1S/C34H58O5/c1-7-20(2)21(3)8-9-22(4)26-12-13-27-25-11-10-23-18-24(39-32-31(37)30(36)29(35)19-38-32)14-16-33(23,5)28(25)15-17-34(26,27)6/h10,20-22,24-32,35-37H,7-9,11-19H2,1-6H3/t20?,21?,22-,24?,25+,26-,27+,28+,29-,30+,31-,32-,33+,34-/m1/s1 |
| InChIKey |
WSOCENGEMROAFB-BLUALUFHSA-N |
| Molecular Weight |
546.833 g/mol |
| SMILES |
O[C@]1([C@@](CO[C@@]([C@@]1(O)[H])(OC1CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](CCC(C(CC)C)C)(C)[H])[H])[H])C)[H])C)[H])(O)[H])[H] |
| SPLASH |
splash10-03dj-0000950000-f148968008482dde1505 |
| Source of Spectrum |
X3-35-492-48 |
| Wiley ID |
1691758 |
![(2R,3R,4S,5R)-2-[(8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-((R)-1,4,5-trimethyl-heptyl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yloxy]-tetrahydro-pyran-](/api/spectrum/4kfX2xv5QsI/structure.png?h=300&w=458 "(2R,3R,4S,5R)-2-[(8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-((R)-1,4,5-trimethyl-heptyl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yloxy]-tetrahydro-pyran-")
