| SpectraBase Spectrum ID |
HQMSWzRGE9n |
| Name |
2H-Pyran, tetrahydro-2-[[(3.beta.,20S)-21-iodo-20-methylpregn-7-en-3-yl]oxy]- |
| CAS Registry Number |
119878-94-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H43IO2 |
| InChI |
InChI=1S/C27H43IO2/c1-18(17-28)22-9-10-23-21-8-7-19-16-20(30-25-6-4-5-15-29-25)11-13-26(19,2)24(21)12-14-27(22,23)3/h8,18-20,22-25H,4-7,9-17H2,1-3H3/t18-,19?,20+,22-,23+,24+,25?,26+,27-/m1/s1 |
| InChIKey |
CJQJQGRLJZNFQN-CRHOZFEHSA-N |
| Molecular Weight |
526.543 g/mol |
| SMILES |
C1=2[C@]3([C@]([C@@]([C@@](CI)(C)[H])(CC3)[H])(C)CC[C@@]1([C@]1(CC[C@](OC3OCCCC3)(CC1CC2)[H])C)[H])[H] |
| SPLASH |
splash10-000i-9000210000-9e093fc297d0c0cdb250 |
| Source of Spectrum |
J-54-2122-4 |
| Synonyms |
Pregnane, 2H-pyran deriv.
(20S)-21-iodo-20-methylpregn-7-en-3.beta.-ol tetrahydropyranyl ether
2-{[(1R,2S,5S,11R,14R,15R)-14-[(2S)-1-iodopropan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-9-en-5-yl]oxy}oxane |
| Wiley ID |
1402802 |
![2H-Pyran, tetrahydro-2-[[(3.beta.,20S)-21-iodo-20-methylpregn-7-en-3-yl]oxy]-](/api/spectrum/HQMSWzRGE9n/structure.png?h=300&w=458 "2H-Pyran, tetrahydro-2-[[(3.beta.,20S)-21-iodo-20-methylpregn-7-en-3-yl]oxy]-")
