Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Ingredient: 1Target: 18Links: 24
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 67630
- Core Entity Id
- 130279
- Source Entity Count
- 1
- Preferred Name
- 2'-O-Methyladenosine
- Name En
- Pubchem Id
- 102213
- Smiles Canonical
- COC1C(C(OC1N2C=NC3=C(N=CN=C32)N)CO)O
- Molecular Formula
- C11H15N5O4
- Molecular Weight
- 281.1100
- Inchikey
- FPUGCISOLXNPPC-IOSLPCCCSA-N
- Inchi
- InChI=1S/C11H15N5O4/c1-19-8-7(18)5(2-17)20-11(8)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -0.5000
- Num H Donors
- 3
- Num H Acceptors
- 8
- Num Rotatable Bonds
- 3
- Drug Likeness
- Polar Surface Area
- 129.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2'-O-Methyladenosine
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
2'-O-Methyladenosine
Itcmdb Generated
ITX-INGREDIENT-64B4ECEB6630
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
281.110
Molecular Formula
C11H15N5O4
Fda Maximum Daily Dose (Fdamdd)
0.025
Quantitative Estimate Of Drug Likeness（Qed）
0.542