Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Herb: 1Ingredient: 1Target: 11Links: 23
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 67939
- Core Entity Id
- 130588
- Source Entity Count
- 1
- Preferred Name
- 3,8,9-trihydroxy-6H-benzo[c]chromen-6-one
- Name En
- Pubchem Id
- 60198001
- Smiles Canonical
- C1=CC2=C(C=C1O)OC(=O)C3=CC(=C(C=C23)O)O
- Molecular Formula
- C13H8O5
- Molecular Weight
- 244.0400
- Inchikey
- HHXMEXZVPJFAIJ-UHFFFAOYSA-N
- Inchi
- InChI=1S/C13H8O5/c14-6-1-2-7-8-4-10(15)11(16)5-9(8)13(17)18-12(7)3-6/h1-5,14-16H
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.0000
- Num H Donors
- 3
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 0
- Drug Likeness
- Polar Surface Area
- 87.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
3,8,9-trihydroxy-6H-benzo[c]chromen-6-one
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
3,8,9-trihydroxy-6H-benzo[c]chromen-6-one
Itcmdb Generated
ITX-INGREDIENT-70F7649306C3
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
244.040
Molecular Formula
C13H8O5
Fda Maximum Daily Dose (Fdamdd)
0.934
Quantitative Estimate Of Drug Likeness（Qed）
0.320