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

MNXM1461 is deprecated and here replaced by MNXM728676
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM728676

	#reac
in my sandbox	0
in MNXref (generic)	10
in models (compartimentalized)	1

formula

C₂₈H₄₆O

charge

mass

398.35487

reference

chebi:16495

InChIKey

OWKGVPXWOHLTSL-LIUJFMQASA-N

InChI

InChI=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

SMILES

CC(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@@]21C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16495 chebi:16495	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	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	4alpha-Methyl-5alpha-cholest-7-en-3-one
seed.compound:cpd02719 seedM:cpd02719	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	4alpha-methyl-5alpha-cholest-7-en-3-one
lipidmaps:LMST01010208 lipidmapsM:LMST01010208	4alpha-methyl-5alpha-cholest-7-en-3-one 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