| SpectraBase Spectrum ID |
5AExPqka3C6 |
| Name |
(2Z,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2-(oxidanylmethylidene)-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one |
| Alternate Name(s) |
(2Z,5S,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-2-(hydroxymethylene)-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
(2Z,5S,8R,9S,10S,13R,14S,17R)-2-(hydroxymethylidene)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H46O2 |
| InChI |
InChI=1S/C28H46O2/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-21-15-26(30)20(17-29)16-28(21,5)25(22)13-14-27(23,24)4/h17-19,21-25,29H,6-16H2,1-5H3/b20-17-/t19-,21+,22+,23-,24+,25+,27-,28+/m1/s1 |
| InChIKey |
HANWTWIRKYRHGG-RTSMANDKSA-N |
| Molecular Weight |
414.674 g/mol |
| SMILES |
O\C=C\1C[C@@]2([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC[C@]2(CC1=O)[H])[H])C |
| SPLASH |
splash10-0cdi-9553700000-ebf7c7b5ca6c4f9d13db |
| Source of Spectrum |
U-1995-893-4 |
| Wiley ID |
766887 |
![(2Z,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2-(oxidanylmethylidene)-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one](/api/spectrum/5AExPqka3C6/structure.png?h=300&w=458 "(2Z,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2-(oxidanylmethylidene)-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one")
