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zymosterone

MNXM97119 is deprecated and here replaced by MNXM733491
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM733491 Image of MNXM733491
referencechebi:52386
formulaC27H42O
global charge0
mol weight382.632
InChIKeyAUNLIRXIJAVBNM-ZSBATXSLSA-N
InChIInChI=1S/C27H42O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,19-20,23-24H,6,8-17H2,1-5H3/t19-,20+,23-,24+,26+,27-/m1/s1
SMILESCC(C)=CCC[C@@H](C)[C@H]1CC[C@H]2C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C[C@@H]1CC3
MNX internals
InChI (mnx)InChI=1/C27H42O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,19-20,23-24H,6,8-17H2,1-5H3/t19-,20+,23-,24+,26+,27-/m1/s1 Image of MNXM733491
SMILES (mnx)[CH3:1][C:18]([CH3:2])=[CH:7][CH2:6][CH2:8][C@@H:19]([CH3:3])[C@H:23]1[CH2:11][CH2:12][C@H:24]2[C:22]3=[C:25]([CH2:14][CH2:16][C@:27]12[CH3:5])[C@@:26]1([CH3:4])[CH2:15][CH2:13][C:21](=[O:28])[CH2:17][C@@H:20]1[CH2:9][CH2:10]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)9
in models (compartimentalized) 8
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-194661
reactomeM:R-ALL-194661
CHEBI:52386
chebi:52386
AUNLIRXIJAVBNM-ZSBATXSLSA-N 		zymosterone
5alpha-cholesta-8,24-dien-3-one
zymosterol intermediate 2

bigg.metabolite:M01067
biggM:M01067
vmhM:M01067
vmhmetabolite:M01067
AUNLIRXIJAVBNM-ZSBATXSLSA-N
AUNLIRXIJAVBNM-ZSFXRWSJSA-N 		5Alpha-Cholesta-8,24-Dien-3-One
hmdb:HMDB0304222
AUNLIRXIJAVBNM-ZSBATXSLSA-N 		5alpha-cholesta-8,24-dien-3-one
(2S,7S,11R,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylhept-5-en-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-1(10)-en-5-one
Zymosterone

seed.compound:cpd24507
seedM:cpd24507
AUNLIRXIJAVBNM-ZSBATXSLSA-N 		5alpha-cholesta-8,24-dien-3-one
zymosterone

bigg.metabolite:zym_int2
biggM:zym_int2
AUNLIRXIJAVBNM-ZSBATXSLSA-N 		Zymosterol intermediate 2

kegg.compound:C22136
keggC:C22136
AUNLIRXIJAVBNM-ZSBATXSLSA-N 		Zymosterone
5alpha-Cholesta-8,24-dien-3-one

lipidmaps:LMST01010168
lipidmapsM:LMST01010168
AUNLIRXIJAVBNM-ZSBATXSLSA-N 		Zymosterone
5alpha-cholesta-8,24-dien-3-one
O
ST 27:3

vmhM:zym_int2
vmhmetabolite:zym_int2
AUNLIRXIJAVBNM-ZSBATXSLSA-N 		zymosterol intermediate 2
4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol

SLM:000485370
slm:000485370
AUNLIRXIJAVBNM-ZSBATXSLSA-N 		zymosterone

metacyc.compound:CPD-4581
metacycM:CPD-4581
AUNLIRXIJAVBNM-ZSBATXSLSA-N 		zymosterone
5alpha-cholesta-8,24-dien-3-one

biggM:M_M01067
biggM:M_zym_int2
keggC:M_C22136
seedM:M_cpd24507
vmhM:M_M01067
vmhM:M_zym_int2 		secondary/obsolete/fantasy identifier