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4,4-Dimethyl-14a-formyl-5alpha-cholesta-8,24-dien-3beta-ol

Properties

Image

Occurences in reactions

MNX_ID

MNXM6859

	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	2

formula

C₃₀H₄₈O₂

charge

mass

440.36543

reference

chebi:166681

InChIKey

PGGIMLIQOHYFIS-PUXRVUTHSA-N

InChI

InChI=1S/C30H48O2/c1-20(2)9-8-10-21(3)22-14-18-30(19-31)24-11-12-25-27(4,5)26(32)15-16-28(25,6)23(24)13-17-29(22,30)7/h9,19,21-22,25-26,32H,8,10-18H2,1-7H3/t21-,22-,25+,26+,28-,29-,30-/m1/s1

SMILES

CC(C)=CCC[C@@H](C)[C@H]1CC[C@@]2(C=O)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:166681 chebi:166681	4,4-Dimethyl-14a-formyl-5alpha-cholesta-8,24-dien-3beta-ol (3S,5R,10S,13R,14S,17R)-3-hydroxy-4,4,10,13-tetramethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-14-carbaldehyde
metacyc.compound:CPD-4573 metacycM:CPD-4573	30-oxolanosterol 14-oxo-lanosterol 4,4-dimethyl-14alpha-formyl-5alpha-cholesta-8,24-dien-3beta-ol
lipidmaps:LMST01010222 lipidmapsM:LMST01010222	32-oxolanosterol 3beta-hydroxylanosta-8,24-dien-32-al 4,4-dimethyl-14alpha-formyl-5alpha-cholesta-8,24-dien-3beta-ol O2 ST 30:3
bigg.metabolite:M00937 biggM:M00937	4,4-Dimethyl-14Alpha-Formyl-5Alpha-Cholesta-8,24-Dien-3Beta-Ol
hmdb:HMDB0062378	4,4-dimethyl-14alpha-formyl-5alpha-cholesta-8,24-dien-3beta-ol (2S,5S,7R,11S,14R,15R)-5-hydroxy-2,6,6,15-tetramethyl-14-[(2R)-6-methylhept-5-en-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-1(10)-ene-11-carbaldehyde 32-Ketolanosterol 4,4-Dimethyl-14a-formyl-5a-cholesta-8,24-dien-3b-ol 4,4-Dimethyl-14alpha-formyl-5alpha-cholesta-8,24-dien-3beta-ol
seed.compound:cpd24501 seedM:cpd24501	4,4-dimethyl-14alpha-formyl-5alpha-cholesta-8,24-dien-3beta-ol 14-oxo-lanosterol 30-oxolanosterol
hmdb:HMDB62378 biggM:M_M00937 seedM:M_cpd24501	secondary/obsolete/fantasy identifier