Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 63740
- Core Entity Id
- 110758
- Source Entity Count
- 1
- Preferred Name
- Gamma-Glutamyl-S-Methylcysteine Sulfoxide
- Name En
- Pubchem Id
- 13894651
- Smiles Canonical
- CS(=O)CC(C(=O)O)NC(=O)CCC(C(=O)O)N
- Molecular Formula
- C9H16N2O6S
- Molecular Weight
- 280.3000
- Inchikey
- MQEBEBZYRKXMDL-UHFFFAOYSA-N
- Inchi
- InChI=1S/C9H16N2O6S/c1-18(17)4-6(9(15)16)11-7(12)3-2-5(10)8(13)14/h5-6H,2-4,10H2,1H3,(H,11,12)(H,13,14)(H,15,16)
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -5.0000
- Num H Donors
- 4
- Num H Acceptors
- 8
- Num Rotatable Bonds
- 8
- Drug Likeness
- Polar Surface Area
- 166.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Gamma-Glutamyl-S-Methylcysteine Sulfoxide
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Gamma-Glutamyl-S-Methylcysteine Sulfoxide
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT24049
Itcmdb Generated
ITX-INGREDIENT-DB797B9738F4
Attributes
Merged source attributes and domain-specific metadata.
Type
Metabolic ingredients
Version
v2
Suppress
0