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4alpha-methyl-5alpha-cholest-7-en-3-one

MNXM1461 is deprecated and here replaced by MNXM728676
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM728676 Image of MNXM728676
referencechebi:16495
formulaC28H46O
global charge0
mol weight398.675
InChIKeyOWKGVPXWOHLTSL-LIUJFMQASA-N
InChIInChI=1S/C28H46O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h10,18-20,22-25H,7-9,11-17H2,1-6H3/t19-,20+,22-,23+,24+,25+,27-,28+/m1/s1
SMILESCC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4[C@H](C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C28H46O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h10,18-20,22-25H,7-9,11-17H2,1-6H3/t19-,20+,22-,23+,24+,25+,27-,28+/m1/s1 Image of MNXM728676
SMILES (mnx)[CH3:1][CH:18]([CH3:2])[CH2:8][CH2:7][CH2:9][C@@H:19]([CH3:3])[C@H:22]1[CH2:12][CH2:13][C@H:24]2[C:21]3=[CH:10][CH2:11][C@H:23]4[C@H:20]([CH3:4])[C:26](=[O:29])[CH2:15][CH2:17][C@:28]4([CH3:6])[C@H:25]3[CH2:14][CH2:16][C@:27]12[CH3:5]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:16495
chebi:16495
OWKGVPXWOHLTSL-LIUJFMQASA-N 		4alpha-methyl-5alpha-cholest-7-en-3-one
(4alpha,5alpha)-4-methylcholest-7-en-3-one
4alpha-Methyl-5alpha-cholest-7-en-3-one
4alpha-methyllathosterone
hmdb:HMDB0011606
OWKGVPXWOHLTSL-LIUJFMQASA-N 		4-alpha-Methyl-5-alpha-cholest-7-en-3-one
(1R,2S,6S,7S,11R,14R,15R)-2,6,15-trimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-9-en-5-one
(4a,5a)-4-Methylcholest-7-en-3-one
(4alpha,5alpha)-4-Methylcholest-7-en-3-one
(4alpha,5alpha)-4-methylcholest-7-en-3-one
4-a-Methyl-5-a-cholest-7-en-3-one
4-alpha-methyl-5-alpha-cholest-7-en-3-one
4a-Methyl-5a-cholest-7-en-3-one
4alpha-Methyl-5alpha-cholest-7-en-3-one
4alpha-methyl-5alpha-cholest-7-en-3-one

sabiork.compound:7327
sabiorkM:7327
kegg.compound:C04453
keggC:C04453
OWKGVPXWOHLTSL-LIUJFMQASA-N 		4alpha-Methyl-5alpha-cholest-7-en-3-one

seed.compound:cpd02719
seedM:cpd02719
OWKGVPXWOHLTSL-LIUJFMQASA-N 		4alpha-Methyl-5alpha-cholest-7-en-3-one
4alpha-methyl-5alpha-cholest-7-en-3-one

metacyc.compound:4-ALPHA-METHYL-5-ALPHA-CHOLEST-7-EN-3-ON
metacycM:4-ALPHA-METHYL-5-ALPHA-CHOLEST-7-EN-3-ON
SLM:000000913
slm:000000913
OWKGVPXWOHLTSL-LIUJFMQASA-N 		4alpha-methyl-5alpha-cholest-7-en-3-one

lipidmaps:LMST01010208
lipidmapsM:LMST01010208
OWKGVPXWOHLTSL-LIUJFMQASA-N 		Lophenone
4alpha-Methyl-5alpha-cholest-7-en-3-one
4alpha-methyl-5alpha-cholest-7-en-3-one
O
ST 28:2

hmdb:HMDB11606
chebi:12049
chebi:1947
chebi:20487
chebi:71571
keggC:M_C04453
seedM:M_cpd02719 		secondary/obsolete/fantasy identifier