Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Ingredient: 1Target: 1Links: 2
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 18182
- Core Entity Id
- 23386
- Source Entity Count
- 1
- Preferred Name
- Ephedralone
- Name En
- Pubchem Id
- 13223157
- Smiles Canonical
- Molecular Formula
- C11H9NO4
- Molecular Weight
- 219.1900
- Inchikey
- JUQPPCMGDXBUFQ-UHFFFAOYSA-N
- Inchi
- InChI=1S/C11H9NO4/c1-16-6-2-3-7-8(4-6)12-9(11(14)15)5-10(7)13/h2-5H,1H3,(H,12,13)(H,14,15)
- Isomeric Smiles
- Cas Id
- 77474-33-0
- Ob Score
- Mol Logp
- 1.3000
- Num H Donors
- 2
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 75.6000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Ephedralone
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Ephedralone
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
ephedralone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
ephedralone
Role
preferred
Source
TCMBank
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Cas
77474-33-0
Herb
HBIN025232
Tcm Id
4612
Tcmbank
TCMBANKIN010669
Etcm Ingredient
ephedralone
Itcmdb Generated
ITX-INGREDIENT-B08347E75462
Attributes
Merged source attributes and domain-specific metadata.
Cas Id
77474-33-0
Molecular Weight
219.050
Molecular Weight
219.19
Molecular Formula
C11H9NO4
Molecular Formula
C11H9NO4
Molecular Formula
C11H9NO4
Fda Maximum Daily Dose (Fdamdd)
0.061
Quantitative Estimate Of Drug Likeness（Qed）
0.796