4-methylene-D-glutamic acid
PubChem CID: 7282388
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| Compound Synonyms | 4-methylene-D-glutamic acid, (2R)-2-amino-4-methylidenepentanedioic acid, CHEMBL38924, 4-methylidene-D-glutamic acid, CHEBI:48032, SCHEMBL3981383, BDBM50164448, Q27120912, (2R)-2-amino-4-methylidenepentanedioic acid4-methylidene-D-glutamic acid |
|---|---|
| Topological Polar Surface Area | 101.0 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 199.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Uniprot Id | P23385, P31423 |
| Iupac Name | (2R)-2-amino-4-methylidenepentanedioic acid |
| Prediction Hob | 1.0 |
| Xlogp | -2.9 |
| Molecular Formula | C6H9NO4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | RCCMXKJGURLWPB-SCSAIBSYSA-N |
| Fcsp3 | 0.3333333333333333 |
| Logs | -1.27 |
| Rotatable Bond Count | 4.0 |
| Logd | -0.636 |
| Compound Name | 4-methylene-D-glutamic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 159.053 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 159.053 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 159.14 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.2895258 |
| Inchi | InChI=1S/C6H9NO4/c1-3(5(8)9)2-4(7)6(10)11/h4H,1-2,7H2,(H,8,9)(H,10,11)/t4-/m1/s1 |
| Smiles | C=C(C[C@H](C(=O)O)N)C(=O)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Arachis Hypogaea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all