Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Ingredient: 1Target: 12Links: 21
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 49090
- Core Entity Id
- 92101
- Source Entity Count
- 1
- Preferred Name
- 3-Epifagomine
- Name En
- Pubchem Id
- 10290867
- Smiles Canonical
- C1CNC(C(C1O)O)CO
- Molecular Formula
- C6H13NO3
- Molecular Weight
- 147.0900
- Inchikey
- YZNNBIPIQWYLDM-NGJCXOISSA-N
- Inchi
- InChI=1S/C6H13NO3/c8-3-4-6(10)5(9)1-2-7-4/h4-10H,1-3H2/t4-,5+,6-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -1.4000
- Num H Donors
- 4
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 1
- Drug Likeness
- Polar Surface Area
- 72.7000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
3-Epifagomine
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
3-Epifagomine
Role
preferred
Source
TCMBank
Preferred
Yes
Name
桑白皮
Role
TCM_name
Source
TCMBank
Preferred
No
Name
SANG BAI PI
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
White Mulberry Root-bast
Role
TCM_name_en
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
桑白皮SANG BAI PIWhite Mulberry Root-bast
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN030467
Etcm Ingredient
3-Epifagomine
Itcmdb Generated
ITX-INGREDIENT-B65E6EFEF5DCITX-INGREDIENT-BE175ABE9C63
Attributes
Merged source attributes and domain-specific metadata.
Tcm Name
桑白皮
Tcm Name2
SANG BAI PI
Mol2 Path
/TCM_database/2007_3d_all/06914.mol2
Reference
2513
Tcm Name En
White Mulberry Root-bast
Molecular Weight
147.090
Molecular Formula
C6H13NO3
Fda Maximum Daily Dose (Fdamdd)
0.044
Quantitative Estimate Of Drug Likeness（Qed）
0.348