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| Formula | C11H12N2O3 |
| Net Charge | 0 |
| Average Mass | 220.228 |
| Monoisotopic Mass | 220.08479 |
| SMILES | N[C@@H](Cc1cnc2c(O)cccc12)C(=O)O |
| InChI | InChI=1S/C11H12N2O3/c12-8(11(15)16)4-6-5-13-10-7(6)2-1-3-9(10)14/h1-3,5,8,13-14H,4,12H2,(H,15,16)/t8-/m0/s1 |
| InChIKey | VQSRKJZICBNQJG-QMMMGPOBSA-N |
| Roles Classification |
|---|
| Chemical Roles: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-hydroxy-L-tryptophan (CHEBI:49348) is a L-tryptophan derivative (CHEBI:47994) |
| 7-hydroxy-L-tryptophan (CHEBI:49348) is a 7-hydroxytryptophan (CHEBI:70777) |
| 7-hydroxy-L-tryptophan (CHEBI:49348) is a non-proteinogenic L-α-amino acid (CHEBI:83822) |
| Incoming Relation(s) |
| 7-hydroxy-L-tryptophan residue (CHEBI:141831) is substituent group from 7-hydroxy-L-tryptophan (CHEBI:49348) |
| IUPAC Names |
|---|
| (2S)-2-amino-3-(7-hydroxy-1H-indol-3-yl)propanoic acid |
| 7-hydroxy-L-tryptophan |
| Manual Xrefs | Databases |
|---|---|
| 0AF | PDBeChem |
| Registry Numbers | Sources |
|---|---|
| Reaxys:3613047 | Reaxys |