Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Ingredient: 1Target: 15Links: 24
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 67369
- Core Entity Id
- 130018
- Source Entity Count
- 1
- Preferred Name
- 2-amino adenosine
- Name En
- Pubchem Id
- 72200
- Smiles Canonical
- C1=NC2=C(N=C(N=C2N1C3C(C(C(O3)CO)O)O)N)N
- Molecular Formula
- C10H14N6O4
- Molecular Weight
- 282.1100
- Inchikey
- ZDTFMPXQUSBYRL-UUOKFMHZSA-N
- Inchi
- InChI=1S/C10H14N6O4/c11-7-4-8(15-10(12)14-7)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H4,11,12,14,15)/t3-,5-,6-,9-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -1.4000
- Num H Donors
- 5
- Num H Acceptors
- 9
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 166.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2-amino adenosine
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
2-amino adenosine
Itcmdb Generated
ITX-INGREDIENT-B464CBB08D3B
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
282.110
Molecular Formula
C10H14N6O4
Fda Maximum Daily Dose (Fdamdd)
0.043
Quantitative Estimate Of Drug Likeness（Qed）
0.317