Terameprocol

Details

• Internal ID: 74d4fec9-a46b-4092-b9b1-af8a06dc413c
• Taxonomy: Lignans, neolignans and related compounds > Dibenzylbutane lignans
• IUPAC Name: 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene
• InChI: InChI=1S/C22H30O4/c1-15(11-17-7-9-19(23-3)21(13-17)25-5)16(2)12-18-8-10-20(24-4)22(14-18)26-6/h7-10,13-16H,11-12H2,1-6H3/t15-,16+
• InChI Key: ORQFDHFZSMXRLM-IYBDPMFKSA-N
• Popularity: 114 references in papers

Physical and Chemical Properties

• Molecular Formula: C₂₂H₃₀O₄
• Molecular Weight: 358.50 g/mol
• Exact Mass: 358.21440943 g/mol
• Topological Polar Surface Area (TPSA): 36.90 Ų
• XlogP: 5.60

Synonyms

• 24150-24-1
• Tmndga
• EM-1421
• Tetra-O-methyl-ndga
• meso-Tetra-O-methylnordihydroguaiaretic acid
• EM 1421
• 53YET703F2
• EM1421
• meso-Tetramethoxy-4,4'-(2,3-dimethyltetramethylene)dipyrocatechol
• 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene
• Tetra-O-methylnordihydroguaiaretic acid
• terameprocolum
• 4,4'-(2,3-Dimethyl-1,4-butanediyl)bis-1,2-dimethoxybenzene
• NSC136955
• 4-((2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl)-1,2-dimethoxybenzene
• tetra-O-methyl NDGA
• FW-358.2
• RefChem:891363
• tetramethyl NDGA
• (2R,3S)-2,3-dimethyl-1,4-bis(3,4-bimethoxylphenyl)-butane
• rel-4,4'-((2R,3S)-2,3-Dimethylbutane-1,4-diyl)bis(1,2-dimethoxybenzene)
• Terameprocol (INN/USAN)
• Terameprocol [USAN:INN]
• UNII-53YET703F2
• meso-tetra-O-methyl nordihydroguaiaretic acid
• TERAMEPROCOL [INN]
• TERAMEPROCOL [USAN]
• Benzene,4-[(2R,3S)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxy-,rel-
• MLS006010717
• CHEMBL90983
• SCHEMBL194588
• TERAMEPROCOL [WHO-DD]
• orb1306216
• meso-1,4-Bis-(3,4-dimethoxyphenyl)-2,3-dimethylbutane
• SCHEMBL30094578
• Terameprocol, >=98% (HPLC)
• CHEBI:177824
• ORQFDHFZSMXRLM-IYBDPMFKSA-N
• Tetramethylnordihydroguaiaretic acid
• tetramethyl-nordihydroguaiaretic acid
• tetramethyl Nordihydroguaiaretic Acid
• 4-[(2r,3s)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene
• DB12226
• NCGC00346832-01
• BP-42848
• HY-10447
• MS-25644
• SMR004701682
• CS-0002608
• NS00071549
• D09014
• 2,3-Dimethyl-1,4-bis-(3,4-dimethoxyphenyl)butane
• BRD-K76788410-001-01-6
• Q27261142
• 1,4-BIS(3,4-DIMETHOXYPHENYL)-2,3-DIMETHYL-, MESO-
• Butane, 1,4-bis(3,4-dimethoxyphenyl)-2,3-dimethyl-, meso-
• Tetramethoxy-4,4'-(2,3-dimethyltetramethylene)dipyrocatechol
• 1,1'-((2R*,3S*)-2,3-DIMETHYLBUTANE-1,4-DIYL)BIS(3,4-DIMETHOXYBENZENE)
• 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethyl-butyl]-1,2-dimethoxy-benzene
• rel-4-[(2R,3S)-4-(3,4-Dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene
• BENZENE, 4-((2R,3S)-4-(3,4-DIMETHOXYPHENYL)-2,3-DIMETHYLBUTYL)-1,2-DIMETHOXY-, REL-

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	96.51%	96.09%
CHEMBL2581	P07339	Cathepsin D	95.05%	98.95%
CHEMBL1255126	O15151	Protein Mdm4	93.23%	90.20%
CHEMBL2535	P11166	Glucose transporter	89.27%	98.75%
CHEMBL3492	P49721	Proteasome Macropain subunit	87.91%	90.24%
CHEMBL3060	Q9Y345	Glycine transporter 2	85.97%	99.17%
CHEMBL1075094	Q16236	Nuclear factor erythroid 2-related factor 2	84.83%	96.00%
CHEMBL1293249	Q13887	Kruppel-like factor 5	84.77%	86.33%
CHEMBL5608	Q16288	NT-3 growth factor receptor	84.35%	95.89%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	83.98%	94.45%
CHEMBL225	P28335	Serotonin 2c (5-HT2c) receptor	82.60%	89.62%
CHEMBL4208	P20618	Proteasome component C5	82.45%	90.00%
CHEMBL5747	Q92793	CREB-binding protein	81.51%	95.12%

Plants that contains it

• Otoba novogranatensis
• Schisandra propinqua
• Schisandra rubriflora

Cross-Links

• PubChem: 476861
• NPASS: NPC165106
• ChEMBL: CHEMBL90983
• LOTUS: LTS0050725
• wikiData: Q27261142