| SpectraBase Spectrum ID |
Bm1H4ZReh4w |
| Name |
(2S,3R,6E,8S,9S,10R,13R,14S,17R)-6-hydroxyimino-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2,3-diol |
| Alternate Name(s) |
(2S,3R,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one oxime
(2S,3R,8S,9S,10R,13R,14S,17R)-2,3-dihydroxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-6-one oxime |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H45NO3 |
| InChI |
InChI=1S/C27H45NO3/c1-16(2)7-6-8-17(3)19-9-10-20-18-13-23(28-31)22-14-24(29)25(30)15-27(22,5)21(18)11-12-26(19,20)4/h14,16-21,24-25,29-31H,6-13,15H2,1-5H3/b28-23+/t17-,18+,19-,20+,21+,24-,25+,26-,27-/m1/s1 |
| InChIKey |
RXVIHDNLTKWAIL-IHXRCIKESA-N |
| Molecular Weight |
431.661 g/mol |
| SMILES |
O[C@]1(C[C@]2(C(\C(=N\O)C[C@@]3([C@@]2(CC[C@@]2([C@](CC[C@@]32[H])([C@@](CCCC(C)C)(C)[H])[H])C)[H])[H])=C[C@]1(O)[H])C)[H] |
| SPLASH |
splash10-03di-0001900000-795d06ad7e4af304e97f |
| Source of Spectrum |
F2-44-2617-20 |
| Wiley ID |
1639291 |
![(2S,3R,6E,8S,9S,10R,13R,14S,17R)-6-hydroxyimino-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2,3-diol](/api/spectrum/Bm1H4ZReh4w/structure.png?h=300&w=458 "(2S,3R,6E,8S,9S,10R,13R,14S,17R)-6-hydroxyimino-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-2,3-diol")
