Search MNXref
 Feedback

5alpha-campestan-3-one

MNXM38338 is deprecated and here replaced by MNXM735167
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM735167 Image of MNXM735167
referencechebi:18533
formulaC28H48O
global charge0
mol weight400.691
InChIKeyDDJMOMHMVFXEQF-JBQSTXLYSA-N
InChIInChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h18-21,23-26H,7-17H2,1-6H3/t19-,20-,21+,23+,24-,25+,26+,27+,28-/m1/s1
SMILESCC(C)[C@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h18-21,23-26H,7-17H2,1-6H3/t19-,20-,21+,23+,24-,25+,26+,27+,28-/m1/s1 Image of MNXM735167
SMILES (mnx)[CH3:1][CH:18]([CH3:2])[C@H:19]([CH3:3])[CH2:7][CH2:8][C@@H:20]([CH3:4])[C@H:24]1[CH2:11][CH2:12][C@H:25]2[C@@H:23]3[CH2:10][CH2:9][C@H:21]4[CH2:17][C:22](=[O:29])[CH2:13][CH2:15][C@:27]4([CH3:5])[C@H:26]3[CH2:14][CH2:16][C@:28]12[CH3:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)9
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:18533
chebi:18533
DDJMOMHMVFXEQF-JBQSTXLYSA-N 		5alpha-campestan-3-one
(24R)-24-methyl-5alpha-cholestan-3-one
(24R)-5alpha-Ergostan-3-one
(24R)-5alpha-ergostan-3-one
3-Dehydro-campestanol
5alpha-Campestan-3-one
Campestan-3-one
Methylcholestanone

metacyc.compound:CPD-709
metacycM:CPD-709
DDJMOMHMVFXEQF-JBQSTXLYSA-N 		(5alpha)-campestan-3-one
(24R)-24-methyl-5alpha-cholestan-3-one
3-dehydro-campestanol
methylcholestanone
hmdb:HMDB0012116
DDJMOMHMVFXEQF-JBQSTXLYSA-N 		5alpha-Campestan-3-one
(1S,2S,7S,10R,11S,14R,15R)-14-[(2R,5R)-5,6-dimethylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-5-one
(24R)-24-Methyl-5a-cholestan-3-one
(24R)-24-Methyl-5alpha-cholestan-3-one
(24R)-5a-Ergostan-3-one
(24R)-5alpha-Ergostan-3-one
(24R)-5alpha-ergostan-3-one
(5alpha)-Campestan-3-one
(5alpha)-campestan-3-one
(5alpha,24R)-Ergostan-3-one
(5alpha,24R)-ergostan-3-one
3-Dehydro-campestanol
5a-Campestan-3-one
5alpha-campestan-3-one
Campestan-3-one
Methylcholestanone
Ostreastanone

sabiork.compound:32263
sabiorkM:32263
DDJMOMHMVFXEQF-JBQSTXLYSA-N 		5alpha-Campestan-3-one
(24R)-24-Methyl-5alpha-cholestan-3-one
5alpha-Campestanone

seed.compound:cpd14522
seedM:cpd14522
DDJMOMHMVFXEQF-JBQSTXLYSA-N 		5alpha-Campestan-3-one
(24R)-24-methyl-5alpha-cholestan-3-one
(24R)-5alpha-Ergostan-3-one
(5alpha)-campestan-3-one
3-dehydro-campestanol
methylcholestanone

kegg.compound:C15786
keggC:C15786
DDJMOMHMVFXEQF-FVDUGIFVSA-N 		5alpha-Campestan-3-one
(24R)-5alpha-Ergostan-3-one

lipidmaps:LMST01030123
lipidmapsM:LMST01030123
DDJMOMHMVFXEQF-JBQSTXLYSA-N 		5alpha-campestan-3-one
(24R)-5alpha-ergostan-3-one
O
ST 28:1

hmdb:HMDB12116
keggC:M_C15786
seedM:M_cpd14522 		secondary/obsolete/fantasy identifier