IngredientID 340

2,3,4,6-tetra-o-galloyl-d-glucopyranoside

C35H30O22

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Relationship Network

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Herb: 2Ingredient: 1Target: 1Links: 4
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
340
Core Entity Id
3214
Source Entity Count
1
Preferred Name
2,3,4,6-tetra-o-galloyl-d-glucopyranoside
Name En
Pubchem Id
Smiles Canonical
Molecular Formula
C35H30O22
Molecular Weight
802.6000
Inchikey
Inchi
Isomeric Smiles
Cas Id
52704-75-3
Ob Score
3.0137
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
2,3,4,6-Tetra-O-Galloyl-D-Glucopyranoside
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
2,3,4,6-Tetra-O-Galloyl-D-Glucopyranoside
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
2,3,4,6-tetra-o-galloyl-d-glucopyranoside
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
2,3,4,6-tetra-o-galloyl-d-glucopyranoside
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
2,3,4,6-tetra-o-galloyl-d-glucopyranoside
Role
preferred
Source
TCMBank
Preferred
Yes
Name
2,3,4,6-tetra-o-galloyl-d-glucopyranoside
Role
preferred
Source
itcmdb_public
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Cas
52704-75-3
Herb
HBIN003860
Tcmsp
MOL006847
Sym Map
SMIT08398
Tcmbank
TCMBANKIN009392
Etcm Ingredient
2,3,4,6-tetra-o-galloyl-d-glucopyranoside
Itcmdb Generated
ITX-INGREDIENT-657104997425

Attributes

Merged source attributes and domain-specific metadata.

Type
Other ingredients
Cas Id
52704-75-3
Version
v1,v2
Ob Score
3.0137206923.0137213.014
Suppress
0
Molecule Weight
802.65
Molecular Weight
802.120
Molecular Weight
802.6
Molecular Formula
C35H30O22
Molecular Formula
C35H30O22
Molecular Formula
C35H30O22
Fda Maximum Daily Dose (Fdamdd)
0.004
Quantitative Estimate Of Drug Likeness(Qed)
0.061