Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 3Ingredient: 1Links: 3
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 3628
- Core Entity Id
- 7219
- Source Entity Count
- 1
- Preferred Name
- 3,6-digallylglucose
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C20H20O14
- Molecular Weight
- 456.4400
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- 2.9740
- 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
3,6-Digallylglucose
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
3,6-Digallylglucose
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
3,6-digallylglucose
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
3,6-digallylglucose
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
3,6-digallylglucose
Role
preferred
Source
TCMBank
Preferred
Yes
Name
3,6-digallylglucose
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
AC1O4QKO
Role
alias
Source
HERB_v2
Preferred
No
Name
AC1O4QKO
Role
alias
Source
SymMap_v2
Preferred
No
Name
AC1O4QKO
Role
alias
Source
TCMBank
Preferred
No
Name
AC1O4QKO
Role
alias
Source
itcmdb_public
Preferred
No
Name
[(2R,3R,4R,5R,6S)-3,5,6-trihydroxy-4-(3,4,5-trihydroxybenzoyl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Role
alias
Source
HERB_v2
Preferred
No
Name
[(2R,3R,4R,5R,6S)-3,5,6-trihydroxy-4-(3,4,5-trihydroxybenzoyl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Role
alias
Source
SymMap_v2
Preferred
No
Name
[(2R,3R,4R,5R,6S)-3,5,6-trihydroxy-4-(3,4,5-trihydroxybenzoyl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Role
alias
Source
TCMBank
Preferred
No
Name
[(2R,3R,4R,5R,6S)-3,5,6-trihydroxy-4-(3,4,5-trihydroxybenzoyl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
AC1O4QKO[(2R,3R,4R,5R,6S)-3,5,6-trihydroxy-4-(3,4,5-trihydroxybenzoyl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN007710
Tcmid
30915
Tcmsp
MOL006780
Sym Map
SMIT00338
Tcm Id
8473
Tcmbank
TCMBANKIN005922
Etcm Ingredient
3,6-digallylglucose
Itcmdb Generated
ITX-INGREDIENT-2CD9DD2F23A7
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Version
v1,v2
Ob Score
2.9742.9744385422.974439
Suppress
0
Molecule Weight
456.44
Herb Alias Names
AC1O4QKO[(2R,3R,4R,5R,6S)-3,5,6-trihydroxy-4-(3,4,5-trihydroxybenzoyl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Molecular Weight
456.130
Molecular Weight
456.44
Molecule Formula
C20H20O14
Molecular Formula
C20H24O12
Molecular Formula
C20H20O14
Molecular Formula
C20H20O14
Fda Maximum Daily Dose (Fdamdd)
0.030
Quantitative Estimate Of Drug Likeness（Qed）
0.185