(20R)-CHOLEST-5-EN-3-ALPHA,11-BETA,21-TRIOL-3,21-DISULFATE
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 9CyZlFPZVwB |
|---|---|
| InChI | InChI=1S/C27H46O9S2.K.Na/c1-17(2)6-5-7-18(16-35-37(29,30)31)22-10-11-23-21-9-8-19-14-20(36-38(32,33)34)12-13-26(19,3)25(21)24(28)15-27(22,23)4;;/h8,17-18,20-25,28H,5-7,9-16H2,1-4H3,(H,29,30,31)(H,32,33,34);;/q;2*+1/p-2/t18-,20-,21+,22-,23+,24+,25-,26+,27-;;/m1../s1 |
| InChIKey | XZGNBEPZSYHQFO-TVTBTFNBSA-L |
| Mol Weight | 638.8481 g/mol |
| Molecular Formula | C27H44KNaO9S2 |
| Exact Mass | 638.196151 g/mol |
| Parent InChIKey | PYKNYQHKXCHSMJ-YXYZTQGJSA-L |
| Enantiomer InChIKey | XZGNBEPZSYHQFO-IJDKJFJNSA-L |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3OD |
Cholest-5-ene-3β,11β-diol, 3-acetate
(3S,8S,9S,10R,11R,13S,14S,17R)-10,13-dimethyl-17-[(2S)-1-(phenylsulfonyl)propan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,11-diol
3β,11β-dihydroxypregn-5-en-20-one, 3-acetate
3-BETA,11-ALPHA,16-BETA-TRIHYDROXYPREGN-5-EN-20-ONE
24(.xi.)-methylcholest-5-ene-1.alpha.,3.beta.,11.alpha.-triol
(6R)-2-methyl-6-[(3S,8S,9S,10R,11R,13R,14S,15R,17R)-3,11,15-trihydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3-heptanone
11α,20β,21-trihydroxypregn-4-en-3-one, 20-acetate
Monotrimethylsilyl 3.beta.,11.beta.-dihydroxy-androst-5-ene-17-one
(20R,25R)-CHOLEST-5-ENE-2-BETA,3-ALPHA,21,26-TETRAOL-2,21-DISULFATE;EPIMER-#2
(20R,25R)-CHOLEST-5-ENE-2-BETA,3-ALPHA,21,26-TETRAOL-2,21-DISULFATE;EPIMER-#1
| Title | Journal or Book | Year |
|---|---|---|
| On the Composition of Sulfated Polyhydroxysteroids in Some Ophiuroids and the Structure Determination of Six New Constituents | Journal of Natural Products | 1995 |
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.