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4alpha-methylcholest-8-en-3beta-ol

MNXM4376 is deprecated and here replaced by MNXM736086
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM736086 Image of MNXM736086
referencechebi:28432
formulaC28H48O
global charge0
mol weight400.691
InChIKeySCEZIHJVTBQOLS-GDNVEGMJSA-N
InChIInChI=1S/C28H48O/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/h18-20,22-24,26,29H,7-17H2,1-6H3/t19-,20+,22-,23?,24+,26+,27-,28+/m1/s1
SMILESCC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@@H](C)C1CC3
MNX internals
InChI (mnx)InChI=1/C28H48O/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/h18-20,22-24,26,29H,7-17H2,1-6H3/t19-,20+,22-,23?,24+,26+,27-,28+/m1/s1 Image of MNXM736086
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=[C:25]([CH2:14][CH2:16][C@:27]12[CH3:5])[C@@:28]1([CH3:6])[CH2:17][CH2:15][C@H:26]([OH:29])[C@@H:20]([CH3:4])[CH:23]1[CH2:11][CH2:10]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:28432
chebi:28432
SCEZIHJVTBQOLS-GDNVEGMJSA-N 		4alpha-methylcholest-8-en-3beta-ol
4alpha-Methylcholesta-8-en-3beta-ol

seed.compound:cpd03040
seedM:cpd03040
kegg.compound:C05110
keggC:C05110
SCEZIHJVTBQOLS-GDNVEGMJSA-N 		4alpha-Methylcholesta-8-en-3beta-ol

chebi:1948
chebi:20488
keggC:M_C05110
seedM:M_cpd03040 		secondary/obsolete/fantasy identifier