| SpectraBase Spectrum ID |
IXpMImYJ8bi |
| Name |
(2S,6E,10R,13R,17R)-17-(1,5-dimethylhexyl)-2-hydroxy-6-hydroxyimino-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one |
| Alternate Name(s) |
(2S,6E,10R,13R,17R)-17-(1,5-dimethylhexyl)-6-hydroximino-2-hydroxy-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
(2S,6E,10R,13R,17R)-2-hydroxy-6-hydroxyimino-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
(2S,6E,10R,13R,17R)-6-hydroxyimino-10,13-dimethyl-17-(6-methylheptan-2-yl)-2-oxidanyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H43NO3 |
| InChI |
InChI=1S/C27H43NO3/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/h14,16-21,25,30-31H,6-13,15H2,1-5H3/b28-23+/t17?,18?,19-,20?,21?,25+,26-,27-/m1/s1 |
| InChIKey |
GJRHBVPNSJKQGM-ZNSGTWCQSA-N |
| Molecular Weight |
429.645 g/mol |
| SMILES |
O[C@]1(C[C@]2(C(\C(=N\O)CC3C2CC[C@@]2([C@](CCC32)(C(CCCC(C)C)C)[H])C)=CC1=O)C)[H] |
| SPLASH |
splash10-01q9-0009800000-e563c96f770bc74498db |
| Source of Spectrum |
F2-44-2617-21 |
| Wiley ID |
1639288 |
![(2S,6E,10R,13R,17R)-17-(1,5-dimethylhexyl)-2-hydroxy-6-hydroxyimino-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one](/api/spectrum/IXpMImYJ8bi/structure.png?h=300&w=458 "(2S,6E,10R,13R,17R)-17-(1,5-dimethylhexyl)-2-hydroxy-6-hydroxyimino-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one")
