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stigmasterol

MNXM6385 is deprecated and here replaced by MNXM739074
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM739074 Image of MNXM739074
referencechebi:28824
formulaC29H48O
global charge0
mol weight412.702
InChIKeyHCXVJBMSMIARIN-PHZDYDNGSA-N
InChIInChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1
SMILESCC[C@H](/C=C/[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)C(C)C
MNX internals
InChI (mnx)InChI=1/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1 Image of MNXM739074
SMILES (mnx)[CH3:1][CH2:7][C@H:21](/[CH:9]=[CH:8]/[C@@H:20]([CH3:4])[C@H:25]1[CH2:12][CH2:13][C@H:26]2[C@@H:24]3[CH2:11][CH:10]=[C:22]4[CH2:18][C@@H:23]([OH:30])[CH2:14][CH2:16][C@:28]4([CH3:5])[C@H:27]3[CH2:15][CH2:17][C@:29]12[CH3:6])[CH:19]([CH3:2])[CH3:3]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:28824
chebi:28824
HCXVJBMSMIARIN-PHZDYDNGSA-N 		stigmasterol
(22E)-stigmasta-5,22-dien-3beta-ol
(3beta,22E)-stigmasta-5,22-dien-3-ol
5,22-Cholestadien-24-ethyl-3beta-ol
Stigmasterol
beta-stigmasterol
phytosterol
poriferasterol
stigmasta-5,22-dien-3beta-ol

sabiork.compound:7914
sabiorkM:7914
HCXVJBMSMIARIN-PHZDYDNGSA-N 		Phytosterol
Stigmasterol

kegg.compound:C05442
keggC:C05442
HCXVJBMSMIARIN-PHZDYDNGSA-N 		Stigmasterol
hmdb:HMDB0000937
HCXVJBMSMIARIN-PHZDYDNGSA-N 		Stigmasterol
(1S,2R,5S,10S,11S,14R,15R)-14-[(2R,3E,5S)-5-ethyl-6-methylhept-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-ol
(24S)-24-Ethylcholesta-5,22-dien-3beta-ol
(24S)-5,22-Stigmastadien-3b-ol
(24S)-5,22-Stigmastadien-3beta-ol
(24S)-Stigmast-5,22-dien-3beta-ol
(3b,22E)-Stigmasta-5,22-dien-3-ol
(3beta,22E)-Stigmasta-5,22-dien-3-ol
17-(4-Ethyl-1,5-dimethyl-hex-2-enyl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
24-Ethyl-5,22-cholestadien-3beta-ol
24beta-Ethyl-5,22-cholestadien-3beta-ol
5,22-Cholestadien-24-ethyl-3b-ol
5,22-Cholestadien-24-ethyl-3beta-ol
Phytosterol
Poriferasterol
Stigmasta-5,22(E)-dien-3beta-ol
Stigmasta-5,22-dien-3-b-ol
Stigmasta-5,22-dien-3-beta-ol
Stigmasta-5,22-dien-3b-ol
Stigmasta-5,22-dien-3beta-ol
Stigmasterin
b-Stigmasterol
beta-Stigmasterol
delta5,22-Stigmastadien-3beta-ol
delta5-Stigmasterol

lipidmaps:LMST01040123
lipidmapsM:LMST01040123
HCXVJBMSMIARIN-PHZDYDNGSA-N 		Stigmasterol
O
ST 29:2
stigmasta-5,22E-dien-3beta-ol

seed.compound:cpd03225
seedM:cpd03225
HCXVJBMSMIARIN-PHZDYDNGSA-N 		Stigmasterol
stigmasterol

metacyc.compound:CPD-4162
metacycM:CPD-4162
HCXVJBMSMIARIN-PHZDYDNGSA-N 		stigmasterol

hmdb:HMDB00937
chebi:26774
chebi:8195
keggC:M_C05442
seedM:M_cpd03225 		secondary/obsolete/fantasy identifier