| SpectraBase Spectrum ID |
LoUjp0x20nb |
| Name |
(1S,3R,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-[(1S)-1-methyl-2-tetrahydropyran-2-yloxy-ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol |
| Alternate Name(s) |
(1S,3R,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-[(2S)-1-(2-oxanyloxy)propan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
(1S,3R,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-[(2S)-1-(oxan-2-yloxy)propan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H44O4 |
| InChI |
InChI=1S/C27H44O4/c1-17(16-31-25-6-4-5-13-30-25)21-9-10-22-20-8-7-18-14-19(28)15-24(29)27(18,3)23(20)11-12-26(21,22)2/h7,17,19-25,28-29H,4-6,8-16H2,1-3H3/t17-,19-,20+,21-,22+,23+,24+,25?,26-,27+/m1/s1 |
| InChIKey |
IXRZDKYIWZAGQK-SENXECOMSA-N |
| Molecular Weight |
432.645 g/mol |
| SMILES |
O[C@]1(C[C@@](CC=2[C@]1([C@]1(CC[C@@]3([C@](CC[C@]3([C@@]1(CC2)[H])[H])([C@@](COC1OCCCC1)(C)[H])[H])C)[H])C)(O)[H])[H] |
| SPLASH |
splash10-053r-9004000000-aab7b28205b8029bbf3c |
| Source of Spectrum |
H-64-1886-0 |
| Wiley ID |
1382460 |
![(1S,3R,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-[(1S)-1-methyl-2-tetrahydropyran-2-yloxy-ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol](/api/spectrum/LoUjp0x20nb/structure.png?h=300&w=458 "(1S,3R,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-[(1S)-1-methyl-2-tetrahydropyran-2-yloxy-ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-1,3-diol")
