Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 12Links: 13
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 66051
- Core Entity Id
- 128700
- Source Entity Count
- 1
- Preferred Name
- 1,3,5,8-Tetrahydroxyxanthone
- Name En
- Pubchem Id
- 5281626
- Smiles Canonical
- C1=CC(=C2C(=C1O)C(=O)C3=C(C=C(C=C3O2)O)O)O
- Molecular Formula
- C13H8O6
- Molecular Weight
- 260.0300
- Inchikey
- MPXAWSABMVLIBU-UHFFFAOYSA-N
- Inchi
- InChI=1S/C13H8O6/c14-5-3-8(17)10-9(4-5)19-13-7(16)2-1-6(15)11(13)12(10)18/h1-4,14-17H
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.1000
- Num H Donors
- 4
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 0
- Drug Likeness
- Polar Surface Area
- 107.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
1,3,5,8-Tetrahydroxyxanthone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
1,3,5,8-Tetrahydroxyxanthone
Itcmdb Generated
ITX-INGREDIENT-0C6A0DBD6F8A
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
260.030
Molecular Formula
C13H8O6
Fda Maximum Daily Dose (Fdamdd)
0.447
Quantitative Estimate Of Drug Likeness（Qed）
0.362