Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Ingredient: 1Target: 3Links: 6
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 71077
- Core Entity Id
- 133726
- Source Entity Count
- 1
- Preferred Name
- corynantheol
- Name En
- Pubchem Id
- 598565
- Smiles Canonical
- C=CC1CN2CCC3=C(C2CC1CCO)NC4=CC=CC=C34
- Molecular Formula
- C19H24N2O
- Molecular Weight
- 296.1900
- Inchikey
- IILQILGCNGUUHT-UHFFFAOYSA-N
- Inchi
- InChI=1S/C19H24N2O/c1-2-13-12-21-9-7-16-15-5-3-4-6-17(15)20-19(16)18(21)11-14(13)8-10-22/h2-6,13-14,18,20,22H,1,7-12H2
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.9000
- Num H Donors
- 2
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 3
- Drug Likeness
- Polar Surface Area
- 39.3000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
corynantheol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
corynantheol
Itcmdb Generated
ITX-INGREDIENT-EE9484A88831
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
296.190
Molecular Formula
C19H24N2O
Fda Maximum Daily Dose (Fdamdd)
0.970
Quantitative Estimate Of Drug Likeness（Qed）
0.853