MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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24-epicampesterol

	Properties	Image
MNX_ID	MNXM35629
reference	chebi:19809
formula	C₂₈H₄₈O
global charge	0
mol weight	400.691
InChIKey	SGNBVLSWZMBQTH-ZRUUVFCLSA-N
InChI	InChI=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/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20+,22-,23-,24+,25-,26-,27-,28+/m0/s1
SMILES	CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](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/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20+,22-,23-,24+,25-,26-,27-,28+/m0/s1
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][CH:9]=[C:21]4[CH2:17][C@@H:22]([OH: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)	8
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:19809 chebi:19809 SGNBVLSWZMBQTH-ZRUUVFCLSA-N	24-epicampesterol (3beta)-ergost-5-en-3-ol 22,23-dihydrobrassicasterol ergost-5-en-3beta-ol
seed.compound:cpd25054 seedM:cpd25054 SGNBVLSWZMBQTH-ZRUUVFCLSA-N	(24S)-methylcholest-5-en-3beta-ol (3beta)-ergost-5-en-3-ol 24-epi-campesterol 24-methyl-5-cholestene-3beta-ol delta22-dihydrobrassicasterol delta5-campesterol ergost-5-en-3beta-ol
lipidmaps:LMST01030096 lipidmapsM:LMST01030096 SGNBVLSWZMBQTH-ZRUUVFCLSA-N	22,23-dihydrobrassicasterol O ST 28:1 ergost-5-en-3beta-ol
kegg.compound:C21106 keggC:C21106 SGNBVLSWZMBQTH-UUANRBEWSA-N	24-epi-Campesterol
metacyc.compound:CPD-8134 metacycM:CPD-8134 SGNBVLSWZMBQTH-ZRUUVFCLSA-N	24-epi-campesterol (24S)-24-methyl-5-cholestene-3beta-ol (24S)-methylcholest-5-en-3beta-ol (3beta)-ergost-5-en-3-ol Delta22-dihydrobrassicasterol ergost-5-en-3beta-ol
hmdb:HMDB0034224 SGNBVLSWZMBQTH-ZRUUVFCLSA-N	Dihydrobrassicasterol (1S,2R,5S,10S,11S,14R,15R)-14-[(2R,5S)-5,6-dimethylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-ol (24R)-5-Ergosten-3-beta-ol (24R)-5-Ergosten-3b-ol (24R)-Ergost-5-en-3-beta-ol (24R)-Ergost-5-en-3b-ol (24R)-Methylcholest-5-en-3b-ol (24S)-Methylcholest-5-en-3beta-ol (24S)-beta-Methyl cholesterol (3-beta)-Ergost-5-en-3-ol (3-beta-24R)-Ergost-5-en-3-ol (3b)-Ergost-5-en-3-ol (3b,24R)-Ergost-5-en-3-ol (3beta)-Ergost-5-en-3-ol (3beta)-ergost-5-en-3-ol 22,23-Dihydrobrassicasterol 24 alpha-Methylcholest-5-en-3 beta-ol 24-Epicampesterol 24-Methyl-5-cholestene-3-ol 24-Methyl-5-cholestene-3beta-ol 24-Methylcholest-5-en-3beta-ol 24-Methylcholesterol 24-alpha-Methylcholesterol 24S-Methylcholesterol 24a-Methyl-5-cholesten-3b-ol 24a-Methylcholesterol 24beta-Methylcholesterol 24beta-methylcholesterol Campesterin Campesterol Campesterol, (3beta)-isomer Campesterol, (3beta,24xi)-isomer Campestrol Ergost-5-en-3 beta- ol, 24 epimer Ergost-5-en-3-beta-ol Ergost-5-en-3-ol Ergost-5-en-3beta-ol delta22-Dihydrobrassicasterol delta22-dihydrobrassicasterol delta5-Campesterol delta5-Ergostenol delta5-campesterol delta5-ergostenol
hmdb:HMDB34224 keggC:M_C21106 seedM:M_cpd25054	secondary/obsolete/fantasy identifier