IngredientID 44344

Quercetin-3-O-malonyl-β-D-glucoside

C24H22O15

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Herb: 1Ingredient: 1Links: 1
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
44344
Core Entity Id
87355
Source Entity Count
1
Preferred Name
Quercetin-3-O-malonyl-β-D-glucoside
Name En
Pubchem Id
Smiles Canonical
Molecular Formula
C24H22O15
Molecular Weight
550.1000
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
Quercetin-3-O-malonyl-β-D-glucoside
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Quercetin-3-O-malonyl-β-D-glucoside
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
莴苣
Role
TCM_name
Source
TCMBank
Preferred
No
Name
WO JU
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Garden Lettuce
Role
TCM_name_en
Source
TCMBank
Preferred
No

Aliases

Additional names normalized into the restored final schema.

莴苣WO JUGarden Lettuce

Cross References

Trusted external identifiers retained for this final record.

Tcmbank
TCMBANKIN014723
Etcm Ingredient
Quercetin-3-O-malonyl-β-D-glucoside
Itcmdb Generated
ITX-INGREDIENT-5D861F031A08ITX-INGREDIENT-D4D5469C5156

Attributes

Merged source attributes and domain-specific metadata.

Tcm Name
莴苣
Tcm Name2
WO JU
Mol2 Path
/TCM_database/2007_3d_all/18374.mol2
Reference
6
Tcm Name En
Garden Lettuce
Molecular Weight
550.100
Molecular Formula
C24H22O15
Fda Maximum Daily Dose (Fdamdd)
0.009
Quantitative Estimate Of Drug Likeness(Qed)
0.103