Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Ingredient: 1Target: 1Links: 2
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 71677
- Core Entity Id
- 134326
- Source Entity Count
- 1
- Preferred Name
- d-methylpseudoephedrine
- Name En
- Pubchem Id
- 7059596
- Smiles Canonical
- CC(C(C1=CC=CC=C1)O)N(C)C
- Molecular Formula
- C11H17NO
- Molecular Weight
- 179.1300
- Inchikey
- FMCGSUUBYTWNDP-GXSJLCMTSA-N
- Inchi
- InChI=1S/C11H17NO/c1-9(12(2)3)11(13)10-7-5-4-6-8-10/h4-9,11,13H,1-3H3/t9-,11+/m0/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 1.7000
- Num H Donors
- 1
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 3
- Drug Likeness
- Polar Surface Area
- 23.5000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
d-methylpseudoephedrine
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
d-methylpseudoephedrine
Itcmdb Generated
ITX-INGREDIENT-E32D2DDF9FA3
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
179.130
Molecular Formula
C11H17NO
Fda Maximum Daily Dose (Fdamdd)
0.233
Quantitative Estimate Of Drug Likeness（Qed）
0.763