Search MNXref
 Feedback

4alpha-methylzymosterol

MNXM1804 is deprecated and here replaced by MNXM1104216
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1104216 Image of MNXM1104216
referencechebi:1949
formulaC28H46O
global charge0
mol weight398.675
InChIKeyFOUJWBXBKVVHCJ-YIJYGBTNSA-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/h8,19-20,22-24,26,29H,7,9-17H2,1-6H3/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)[C@@H]1CC3
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/h8,19-20,22-24,26,29H,7,9-17H2,1-6H3/t19-,20+,22-,23+,24+,26+,27-,28+/m1/s1 Image of MNXM1104216
SMILES (mnx)[CH3:1][C:18]([CH3:2])=[CH: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])[C@@H:23]1[CH2:11][CH2:10]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)31
in models (compartimentalized) 6
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:1949
chebi:1949
FOUJWBXBKVVHCJ-YIJYGBTNSA-N 		4alpha-methylzymosterol
(3beta,4alpha,5alpha)-4-methylcholesta-8,24-dien-3-ol
4alpha-Methylzymosterol
4alpha-methyl-5alpha-cholesta-8,24-dien-3beta-ol

CHEBI:181919
chebi:181919
FOUJWBXBKVVHCJ-LVELUJLUSA-N 		(3S,4S,5S,10S,13R)-4,10,13-Trimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
(3S,4S,5S,10S,13R)-4,10,13-trimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

seed.compound:cpd03035
seedM:cpd03035
FOUJWBXBKVVHCJ-YIJYGBTNSA-N 		4-methylzymosterol
4-alpha-methyl-5alpha-cholesta-8,24-dien-3beta-ol
4-methyl-8,24-cholestadienol
4alpha-Methylzymosterol
4alpha-methyl-5alpha-cholesta-8,24-dien-3beta-ol
4alpha-methyl-zymosterol
4mzym

bigg.metabolite:HC02110
biggM:HC02110
FOUJWBXBKVVHCJ-YIJYGBTNSA-N 		4Alpha-Methylzymosterol

kegg.compound:C05103
keggC:C05103
FOUJWBXBKVVHCJ-LVELUJLUSA-N 		4alpha-Methylzymosterol

vmhM:HC02110
vmhmetabolite:HC02110
FOUJWBXBKVVHCJ-YIJYGBTNSA-N 		4alpha-Methylzymosterol
(2S,5S,6S,7S,11R,14R,15R)-2,6,15-trimethyl-14-[(2R)-6-methylhept-5-en-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-en-5-ol
hmdb:HMDB0001217
FOUJWBXBKVVHCJ-YIJYGBTNSA-N 		4alpha-Methylzymosterol
(2S,5S,6S,7S,11R,14R,15R)-2,6,15-trimethyl-14-[(2R)-6-methylhept-5-en-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-en-5-ol
(3b,4a,5a)-4-Methylcholesta-8,24-dien-3-ol
(3beta,4alpha,5alpha)-4-Methylcholesta-8,24-dien-3-ol
(4S,5S)-4,10,13-Trimethyl-17-(6-methylhept-5-en-2-yl)-2,3,4,5,6,7,11,12,14, 15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
4a-Methyl-5a-cholesta-8,24-dien-3b-ol
4alpha-Methyl-5alpha-cholesta-8(9),24-dien-3beta-ol
4alpha-Methyl-5alpha-cholesta-8,24-dien-3beta-ol
4alpha-Methyl-delta8,24-cholestenol

metacyc.compound:4-METHYL-824-CHOLESTADIENOL
metacycM:4-METHYL-824-CHOLESTADIENOL
FOUJWBXBKVVHCJ-YIJYGBTNSA-N 		4alpha-methyl-zymosterol
4-alpha-methyl-5alpha-cholesta-8,24-dien-3beta-ol
4-methyl-8,24-cholestadienol
4-methylcholesta-8,24-dien-3-ol
4alpha-methyl-5alpha-cholesta-8,24-dien-3beta-ol

SLM:000000585
slm:000000585
FOUJWBXBKVVHCJ-YIJYGBTNSA-N 		4alpha-methylzymosterol

lipidmaps:LMST01010202
lipidmapsM:LMST01010202
FOUJWBXBKVVHCJ-YIJYGBTNSA-N 		4alpha-methylzymosterol
(3beta,4alpha,5alpha)-4-methylcholesta-8,24-dien-3-ol
4alpha-Methylzymosterol
4alpha-methyl-5alpha-cholesta-8,24-dien-3beta-ol
O
ST 28:2

hmdb:HMDB0006926
hmdb:HMDB01217
hmdb:HMDB06926
biggM:M_HC02110
keggC:M_C05103
seedM:M_cpd03035
vmhM:M_HC02110 		secondary/obsolete/fantasy identifier