Terameprocol
PubChem CID: 476861
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| Compound Synonyms | terameprocol, 24150-24-1, Tmndga, EM-1421, meso-Tetra-O-methylnordihydroguaiaretic acid, Terameprocol [USAN:INN], EM 1421, 53YET703F2, 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene, TERAMEPROCOL [INN], TERAMEPROCOL [USAN], meso-Tetramethoxy-4,4'-(2,3-dimethyltetramethylene)dipyrocatechol, TERAMEPROCOL [WHO-DD], meso-tetra-O-methyl nordihydroguaiaretic acid, EM1421, Tetra-O-methyl-ndga, (2R,3S)-2,3-dimethyl-1,4-bis(3,4-bimethoxylphenyl)-butane, 1,4-BIS(3,4-DIMETHOXYPHENYL)-2,3-DIMETHYL-, MESO-, Butane, 1,4-bis(3,4-dimethoxyphenyl)-2,3-dimethyl-, meso-, rel-4,4'-((2R,3S)-2,3-Dimethylbutane-1,4-diyl)bis(1,2-dimethoxybenzene), tetramethyl NDGA, 1,1'-((2R*,3S*)-2,3-DIMETHYLBUTANE-1,4-DIYL)BIS(3,4-DIMETHOXYBENZENE), BENZENE, 4-((2R,3S)-4-(3,4-DIMETHOXYPHENYL)-2,3-DIMETHYLBUTYL)-1,2-DIMETHOXY-, REL-, Terameprocol (INN/USAN), terameprocolum, Tetramethoxynordihydroguaiaretic acid, UNII-53YET703F2, NSC136955, Tetra-O-methylnordihydroguaiaretic acid, NSC 136955, 4-((2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl)-1,2-dimethoxybenzene, tetra-O-methyl NDGA, meso-1,4-Bis(3,4-dimethoxyphenyl)dimethylbutane, Benzene,4-[(2R,3S)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxy-,rel-, 1,1'-(2,3-Dimethyl-1,4-butanediyl)bis(3,4-dimethoxybenzene), 4,4'-(2,3-Dimethyl-1,4-butanediyl)bis-1,2-dimethoxybenzene, MLS006010717, CHEMBL90983, SCHEMBL194588, Benzene, 1,1'-(2,3-dimethyl-1,4-butanediyl)bis(3,4-dimethoxy-, meso-1,4-Bis-(3,4-dimethoxyphenyl)-2,3-dimethylbutane, Terameprocol, >=98% (HPLC), CHEBI:177824, ORQFDHFZSMXRLM-IYBDPMFKSA-N, Tetramethylnordihydroguaiaretic acid, tetramethyl-nordihydroguaiaretic acid, 4-[(2r,3s)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene, DB12226, NCGC00346832-01, FW-358.2, HY-10447, MS-25644, SMR004701682, CS-0002608, NS00071549, D09014, BRD-K76788410-001-01-6, Q27261142, Tetramethoxy-4,4'-(2,3-dimethyltetramethylene)dipyrocatechol, 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethyl-butyl]-1,2-dimethoxy-benzene |
|---|---|
| Topological Polar Surface Area | 36.9 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 26.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 352.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Uniprot Id | n.a., P0DTD1 |
| Iupac Name | 4-[(2S,3R)-4-(3,4-dimethoxyphenyl)-2,3-dimethylbutyl]-1,2-dimethoxybenzene |
| Prediction Hob | 0.0 |
| Xlogp | 5.6 |
| Molecular Formula | C22H30O4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | ORQFDHFZSMXRLM-IYBDPMFKSA-N |
| Fcsp3 | 0.4545454545454545 |
| Logs | -5.057 |
| Rotatable Bond Count | 9.0 |
| Logd | 4.257 |
| Compound Name | Terameprocol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 358.214 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 358.214 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 358.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.344402061538462 |
| 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+ |
| Smiles | C[C@H](CC1=CC(=C(C=C1)OC)OC)[C@@H](C)CC2=CC(=C(C=C2)OC)OC |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Schisandra Propinqua (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all