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
- 5621
- Core Entity Id
- 9438
- Source Entity Count
- 1
- Preferred Name
- 4,5-dicaffeoylquinic acid methylester
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C26H26O12
- Molecular Weight
- 530.1400
- 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
4,5-Dicaffeoylquinic Acid Methylester
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
4,5-Dicaffeoylquinic Acid Methylester
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
4,5-dicaffeoylquinic acid methyl ester
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
4,5-dicaffeoylquinic acid methylester
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
4,5-dicaffeoylquinic acid methylester
Role
preferred
Source
TCMBank
Preferred
Yes
Name
4,5-dicaffeoylquinic acid methylester
Role
preferred
Source
itcmdb_public
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
4,5-dicaffeoylquinic acid methyl ester
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN010000
Tcmid
41474
Sym Map
SMIT21441
Tcmbank
TCMBANKIN017057
Etcm Ingredient
4,5-dicaffeoylquinic acid methyl ester
Itcmdb Generated
ITX-INGREDIENT-32378CDE2FC9ITX-INGREDIENT-F364A536977A
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Version
v2
Suppress
0
Molecular Weight
530.140
Molecular Formula
C26H26O12
Fda Maximum Daily Dose (Fdamdd)
0.929
Quantitative Estimate Of Drug Likeness（Qed）
0.213