IngredientID 52741
Kaempferol-3-(2''-O-E-sinapoylsophoroside)-7-O-β-glucopyranoside
C45H52O24
Relationship Network
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 52741
- Core Entity Id
- 95752
- Source Entity Count
- 1
- Preferred Name
- Kaempferol-3-(2''-O-E-sinapoylsophoroside)-7-O-β-glucopyranoside
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C45H52O24
- Molecular Weight
- 976.2800
- 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
Kaempferol-3-(2''-O-E-sinapoylsophoroside)-7-O-β-glucopyranoside
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Kaempferol-3-(2''-O-E-sinapoylsophoroside)-7-O-β-glucopyranoside
Role
preferred
Source
TCMBank
Preferred
Yes
Name
欧洲油菜
Role
TCM_name
Source
TCMBank
Preferred
No
Name
OW ZHOU YOU CAI
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Rape
Role
TCM_name_en
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
欧洲油菜OW ZHOU YOU CAIRape
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN047816
Etcm Ingredient
Kaempferol-3-(2''-O-E-sinapoylsophoroside)-7-O-β-glucopyranoside
Itcmdb Generated
ITX-INGREDIENT-BA1399BB5E3E
Attributes
Merged source attributes and domain-specific metadata.
Tcm Name
欧洲油菜
Tcm Name2
OW ZHOU YOU CAI
Mol2 Path
/TCM_database/2007_3d_all/12094.mol2
Reference
5289
Tcm Name En
Rape
Molecular Weight
976.280
Molecular Formula
C45H52O24
Fda Maximum Daily Dose (Fdamdd)
0.004
Quantitative Estimate Of Drug Likeness（Qed）
0.044