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
- 46759
- Core Entity Id
- 89770
- Source Entity Count
- 1
- Preferred Name
- Apetalic acid 5-O-acetate
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C23H30O6
- Molecular Weight
- 402.2000
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- Num H Donors
- Num H Acceptors
- Num Rotatable Bonds
- Drug Likeness
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Apetalic acid 5-O-acetate
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Apetalic acid 5-O-acetate
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN022899
Etcm Ingredient
Apetalic acid 5-O-acetate
Itcmdb Generated
ITX-INGREDIENT-3378ABEA5A44ITX-INGREDIENT-FF45AFC40688
Attributes
Merged source attributes and domain-specific metadata.
Tcm Name
兰屿胡桐
Tcm Name2
Calophyllum blancoi
Mol2 Path
/TCM_database/2007_3d_all/01471.mol2
Reference
4274
Molecular Weight
402.200
Molecular Formula
C23H30O6
Fda Maximum Daily Dose (Fdamdd)
0.818
Quantitative Estimate Of Drug Likeness（Qed）
0.724