| SpectraBase Spectrum ID |
KJ6LXo2mLJC |
| Name |
7.alpha.-{9-[(4,4,5,5,5-Pentafluoropentyl)sulfonyl]nonyl}-3-O-methoxymethyl-16.beta.,17.beta.-O-sulfurylestra-1,3,5(10)-triene-3,16.beta.,17.beta.-triol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C34H49F5O8S2 |
| InChI |
InChI=1S/C34H49F5O8S2/c1-32-16-14-27-26-13-12-25(45-22-44-2)20-24(26)19-23(30(27)28(32)21-29-31(32)47-49(42,43)46-29)11-8-6-4-3-5-7-9-17-48(40,41)18-10-15-33(35,36)34(37,38)39/h12-13,20,23,27-31H,3-11,14-19,21-22H2,1-2H3/t23-,27?,28+,29+,30-,31+,32+/m1/s1 |
| InChIKey |
DAUMAMKSGYVNEY-UJSWUFGGSA-N |
| Molecular Weight |
744.870 g/mol |
| SMILES |
[C@@]12(OS(O[C@]1(C[C@]1([C@]3(C(CC[C@]21C)c1ccc(cc1C[C@]3(CCCCCCCCCS(=O)(=O)CCCC(C(F)(F)F)(F)F)[H])OCOC)[H])[H])[H])(=O)=O)[H] |
| SPLASH |
splash10-0005-0000009700-ec44119653ccb7a58294 |
| Source of Spectrum |
K-2002-2280-16 |
| Wiley ID |
1613176 |
![7.alpha.-{9-[(4,4,5,5,5-Pentafluoropentyl)sulfonyl]nonyl}-3-O-methoxymethyl-16.beta.,17.beta.-O-sulfurylestra-1,3,5(10)-triene-3,16.beta.,17.beta.-triol](/api/spectrum/KJ6LXo2mLJC/structure.png?h=300&w=458 "7.alpha.-{9-[(4,4,5,5,5-Pentafluoropentyl)sulfonyl]nonyl}-3-O-methoxymethyl-16.beta.,17.beta.-O-sulfurylestra-1,3,5(10)-triene-3,16.beta.,17.beta.-triol")
