IngredientID 51482

1,2,6-Tri-O-Galloyl-Β-D-Glucose

C30H46O4

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Herb: 6Ingredient: 1Links: 6
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
51482
Core Entity Id
94493
Source Entity Count
1
Preferred Name
1,2,6-Tri-O-Galloyl-Β-D-Glucose
Name En
Pubchem Id
Smiles Canonical
Molecular Formula
C30H46O4
Molecular Weight
470.3400
Inchikey
Inchi
Isomeric Smiles
Cas Id
Ob Score
17.7264
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
1,2,6-Tri-O-Galloyl-Β-D-Glucose
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
1,2,6-Tri-O-galloyl-β-D-glucose
Role
preferred
Source
TCMBank
Preferred
Yes
Name
1,2,6-tri-O-galloyl-β-D-glucose
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
唐古特大黄
Role
TCM_name
Source
TCMBank
Preferred
No
Name
TANG GU TE DA HUANG
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Tangut Rhubarb
Role
TCM_name_en
Source
TCMBank
Preferred
No

Aliases

Additional names normalized into the restored final schema.

唐古特大黄TANG GU TE DA HUANGTangut Rhubarb

Cross References

Trusted external identifiers retained for this final record.

Tcmbank
TCMBANKIN039318
Etcm Ingredient
1,2,6-tri-O-galloyl-β-D-glucose
Itcmdb Generated
ITX-INGREDIENT-1EFD3909D174ITX-INGREDIENT-3FF21E5DA1E3

Attributes

Merged source attributes and domain-specific metadata.

Version
v1,v2
Ob Score
17.72637775
Suppress
1
Tcm Name
唐古特大黄
Tcm Name2
TANG GU TE DA HUANG
Mol2 Path
/TCM_database/2007_3d_all/21642.mol2
Reference
2, 660, 4695
Tcm Name En
Tangut Rhubarb
Molecule Weight
470.76
Molecular Weight
470.340
Molecular Formula
C30H46O4
Link Ingredient Id
7550.0
Fda Maximum Daily Dose (Fdamdd)
0.817
Quantitative Estimate Of Drug Likeness(Qed)
0.434