Trichostatin A
PubChem CID: 444732
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | trichostatin A, 58880-19-6, TSA, Trichostatin, Trichostatin A (TSA), (2E,4E,6R)-7-[4-(Dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide, CHEBI:46024, Antibiotic A-300, (R)-Trichostatin A, DTXSID6037063, 3X2S926L3Z, C17H22N2O3, (R,2E,4E)-7-(4-(dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide, MFCD03848392, TRICHOSTATIN A [MI], 2,4-Heptadienamide, 7-(4-(dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxo-, 7-(4-(Dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxo-2,4-heptadienamide, GNF-PF-1011, VTR-297, 58880-19-6 (R-isomer), NSC 311042, NSC-311042, A-300-I, (2E,4E,6R)-7-(4-(dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxo-2,4-heptadienamide, [R-(E,E)]-7-[4-(Dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-2,4-heptadienamide, 2,4-Heptadienamide, 7-(4-(dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxo-, (2E,4E,6R)-, 2,4-Heptadienamide,7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, (2E,4E,6R)-, Trichostatin-A, Tricostatin A, TSA antibioitc, 7-[4-(DIMETHYLAMINO)PHENYL]-N-HYDROXY-4,6-DIMETHYL-7-OXO-2,4-HEPTADIENAMIDE, 2,4-HEPTADIENAMIDE, 7-(4-(DIMETHYLAMINO)PHENYL)-N-HYDROXY-4,6-DIMETHYL-7-OXO-,(2E,4E,6R)-, 2,4-Heptadienamide, 7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, (2E,4E,6R)-, TSN, Trichostatina, trichostatine a, UNII-3X2S926L3Z, Trichlostatin A, Trichostatin(s), NSC311042, (2E,4E,6R)-7-(4-dimethylaminophenyl)-4,6-dimethyl-7-oxo-hepta-2,4-dienehydroxamic acid, (2E,4E,6R)-7-(4-Dimethylaminophenyl)-N-hydroxy-4,6-dimethyl-7-oxo-hepta-2,4-dienamide, (2E,4E,6R)-7-[4-(Dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-2,4-heptadienamide, (2E,4E,6R)-7-[4-(Dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, 2,4-heptadienamide, [R-(E,E)]-7-[4-(Dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-2,4-heptadienamide, (R)-Trichostatin A, TSA, , Trichostatin A,TSA, NCGC_TSA, 1c3r, 3f0r, Trichostatin A (TSA)?, SCHEMBL19886, MLS006011095, SGCTO-002, SCHEMBL675951, GTPL7005, VTR297, DTXCID4017063, CHEBI:93196, (2E,4E)-7-(4-(Dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide, (2E,4E)-7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide, BCPP000035, HMS1362L09, HMS1792L09, HMS1990L09, HMS3403L09, HMS3649O20, BCP01776, EX-A1665, BDBM50005711, HB1402, LMPK01000055, s1045, Trichostatin A from Streptomyces sp., AKOS015899840, CCG-208142, CCG-208681, CS-0499, DB04297, NCGC00162453-01, NCGC00162453-02, NCGC00162453-03, NCGC00162453-04, NCGC00162453-05, NCGC00162453-15, 3C10, AC-35470, AS-74315, HY-15144, PD119680, SMR004702883, NS00034030, SW219664-1, T2477, M02571, Q425894, SR-05000013796, SR-05000013796-3, BRD-K68202742-001-04-1, BRD-K68202742-001-05-8, BRD-K68202742-001-13-2, BRD-K68202742-001-16-5, Trichostatin A, >=98% (HPLC), from Streptomyces sp., Trichostatin A, Streptomyces sp. - CAS 58880-19-6, Trichostatin A??, Vetec(TM) reagent grade, from Streptomyces sp., >=98%, (2E,4E,6R)-7-(4-(Dimethylamino)phen yl)-N-hydroxy-4,6-dimethyl-7-oxo-2,4-heptadienamid e, 7-[4-(Dimethylamino)phenyl]-N-hydroxy-4,6R-dimethyl-7-oxo-2E,4E-heptadienamide, 2,4-Heptadienamide, 7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, (2E,4E,6R)- (9CI), 2,4-Heptadienamide, 7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, [R-(E,E)]-, 611-758-2 |
|---|---|
| Topological Polar Surface Area | 69.6 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 22.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 447.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Uniprot Id | Q969S8, Q6P3E7, Q94F81, B1WBY8, Q13547, P56524, O09106, Q9Z2V6, Q9Z2V5, Q8VH37, Q9UBN7, Q9BY41, Q92769, Q9ZTP8, n.a., Q9Y618, P13726, P20352, O15379, Q9XYC7, Q9UQL6, Q8WUI4, Q9UKV0, Q96DB2, Q70I53, Q15393, Q16637, P10636, P00352, P02791, P04062, Q07953, Q96KQ7, P11473, P49798, P11021, Q96QE3, P18440, O75376, P09960, A5H660, Q8N6T7, P0DTD1 |
| Iupac Name | (2E,4E,6R)-7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide |
| Prediction Hob | 1.0 |
| Target Id | NPT684, NPT688, NPT692, NPT687, NPT685, NPT677, NPT686, NPT5649, NPT689, NPT690, NPT691, NPT5648, NPT4169, NPT93, NPT51, NPT94, NPT5847 |
| Xlogp | 2.7 |
| Molecular Formula | C17H22N2O3 |
| Prediction Swissadme | 1.0 |
| Inchi Key | RTKIYFITIVXBLE-QEQCGCAPSA-N |
| Fcsp3 | 0.2941176470588235 |
| Logs | -3.002 |
| Rotatable Bond Count | 6.0 |
| Logd | 1.888 |
| Compound Name | Trichostatin A |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 302.163 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 302.163 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 302.37 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 2.0 |
| Esol | -3.876736981818182 |
| Inchi | InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-11,13,22H,1-4H3,(H,18,20)/b10-5+,12-11+/t13-/m1/s1 |
| Smiles | C[C@H](/C=C(\C)/C=C/C(=O)NO)C(=O)C1=CC=C(C=C1)N(C)C |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 2.0 |
- 1. Outgoing r'ship
FOUND_INto/from Microtropis Japonica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all