Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 64145
- Core Entity Id
- 111163
- Source Entity Count
- 1
- Preferred Name
- L-Homocysteine Sulfonic Acid
- Name En
- Pubchem Id
- 21252279
- Smiles Canonical
- C(CS)C(N)S(=O)(=O)O
- Molecular Formula
- C3H9NO3S2
- Molecular Weight
- 171.2000
- Inchikey
- MHHDKRFQNZZMOE-GSVOUGTGSA-N
- Inchi
- InChI=1S/C3H9NO3S2/c4-3(1-2-8)9(5,6)7/h3,8H,1-2,4H2,(H,5,6,7)/t3-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -3.3000
- Num H Donors
- 3
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 3
- Drug Likeness
- Polar Surface Area
- 89.8000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
L-Homocysteine Sulfonic Acid
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
L-Homocysteine Sulfonic Acid
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT24970
Itcmdb Generated
ITX-INGREDIENT-091C85267DF0
Attributes
Merged source attributes and domain-specific metadata.
Type
Metabolic ingredients
Version
v2
Suppress
0