3-Aminopentanedioic acid
PubChem CID: 73064
Connections displayed (default: 10).
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| Compound Synonyms | 3-Aminopentanedioic acid, 1948-48-7, 3-Aminoglutaric acid, beta-Glutamic acid, Isoglutamic acid, 3-Aminoglutarate, Pentanedioic acid, 3-amino-, beta-Aminoglutaric acid, GLUTAMIC ACID, BETA, Isoglutamate, MFCD00056698, SFG5X9C3DQ, beta-homoaspartic acid, NSC341646, NSC-341646, 3-azanylpentanedioic acid, 3-AMINOPENTANEDIOICACID, b-Glutamic acid, beta Glutamic acid, NSC 341646, I(2)-Glutamic acid, BETA-HOMOASPARTATE, UNII-SFG5X9C3DQ, BETA-HOMOASPARTICACID, .BETA.-GLUTAMIC ACID, SCHEMBL288510, BDBM92996, CHEBI:28791, .BETA.-AMINOGLUTARIC ACID, DTXSID30173130, BBJIPMIXTXKYLZ-UHFFFAOYSA-N, AKOS006282078, FD10075, HY-W107585, DS-16434, SY239922, DB-008835, CS-0161137, C05574, EN300-109490, Q27103900 |
|---|---|
| Topological Polar Surface Area | 101.0 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 129.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 3-aminopentanedioic acid |
| Prediction Hob | 1.0 |
| Xlogp | -3.9 |
| Molecular Formula | C5H9NO4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | BBJIPMIXTXKYLZ-UHFFFAOYSA-N |
| Fcsp3 | 0.6 |
| Logs | -0.506 |
| Rotatable Bond Count | 4.0 |
| Logd | -0.706 |
| Compound Name | 3-Aminopentanedioic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 147.053 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 147.053 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 147.13 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.9876940000000005 |
| Inchi | InChI=1S/C5H9NO4/c6-3(1-4(7)8)2-5(9)10/h3H,1-2,6H2,(H,7,8)(H,9,10) |
| Smiles | C(C(CC(=O)O)N)C(=O)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Amomum Melegueta (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Anacyclus Monanthos (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Arum Palaestinum (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Astragalus Siculus (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Corydalis Tashiroi (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Euphorbia Cuneata (Plant) Rel Props:Source_db:cmaup_ingredients - 7. Outgoing r'ship
FOUND_INto/from Guizotia Scabra (Plant) Rel Props:Source_db:cmaup_ingredients - 8. Outgoing r'ship
FOUND_INto/from Hakea Trifurcata (Plant) Rel Props:Source_db:cmaup_ingredients - 9. Outgoing r'ship
FOUND_INto/from Leontice Robustum (Plant) Rel Props:Source_db:cmaup_ingredients - 10. Outgoing r'ship
FOUND_INto/from Otholobium Glandulosum (Plant) Rel Props:Source_db:cmaup_ingredients - 11. Outgoing r'ship
FOUND_INto/from Prunus Speciosa (Plant) Rel Props:Source_db:cmaup_ingredients - 12. Outgoing r'ship
FOUND_INto/from Raoulia Australis (Plant) Rel Props:Source_db:cmaup_ingredients - 13. Outgoing r'ship
FOUND_INto/from Senecio Chionophilus (Plant) Rel Props:Source_db:cmaup_ingredients - 14. Outgoing r'ship
FOUND_INto/from Terminalia Brachystemma (Plant) Rel Props:Source_db:cmaup_ingredients