| SpectraBase Spectrum ID |
4vRbhlr4nsk |
| Name |
2'-(3.alpha.-Benzyloxy-5.beta.-norcholan)propan-2'-ol |
| Alternate Name(s) |
1-[(1S,2S,5S,7R,10R,11S,15R)-5-(benzyloxy)-14-[(2R)-butan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-4-yl]propan-1-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H52O2 |
| InChI |
InChI=1S/C33H52O2/c1-6-22(3)27-15-16-28-25-14-13-24-19-31(35-21-23-11-9-8-10-12-23)26(30(34)7-2)20-33(24,5)29(25)17-18-32(27,28)4/h8-12,22,24-31,34H,6-7,13-21H2,1-5H3/t22-,24-,25+,26?,27?,28+,29+,30?,31+,32-,33+/m1/s1 |
| InChIKey |
TUNVGQMSRKJGPR-OILYRMTJSA-N |
| Molecular Weight |
480.777 g/mol |
| SMILES |
OC(C1C[C@@]2([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)[C@@](CC)(C)[H])[H])([H])CC[C@@]2(C[C@@]1(OCc1ccccc1)[H])[H])[H])C)CC |
| SPLASH |
splash10-0a4l-6259200000-ce2b0fe92e5c5b4049d7 |
| Source of Spectrum |
F-48-145-9 |
| Wiley ID |
1395342 |
