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
- 46115
- Core Entity Id
- 89126
- Source Entity Count
- 1
- Preferred Name
- 3-(4-Hydroxybenzyl)-5,6,7-trimethoxychroman-4-one
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C19H20O6
- Molecular Weight
- 344.1300
- 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
3-(4-Hydroxybenzyl)-5,6,7-trimethoxychroman-4-one
Role
preferred
Source
TCMBank
Preferred
Yes
Name
3-(4-Hydroxybenzyl)-5,6,7-trimethoxychroman-4-one
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN020638
Etcm Ingredient
3-(4-Hydroxybenzyl)-5,6,7-trimethoxychroman-4-one
Itcmdb Generated
ITX-INGREDIENT-1FF3CBC3B17BITX-INGREDIENT-C4040152A10A
Attributes
Merged source attributes and domain-specific metadata.
Tcm Name
绵枣儿
Tcm Name2
Scilla nervosa
Mol2 Path
/TCM_database/2007_3d_all/09851.mol2
Reference
2381
Molecular Weight
344.130
Molecular Formula
C19H20O6
Fda Maximum Daily Dose (Fdamdd)
0.130
Quantitative Estimate Of Drug Likeness（Qed）
0.899