Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 8Ingredient: 1Links: 8
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 73156
- Core Entity Id
- 135805
- Source Entity Count
- 1
- Preferred Name
- Laudanosoline
- Name En
- Laudanosoline
- Pubchem Id
- 92716
- Smiles Canonical
- CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)O)O)O)O
- Molecular Formula
- C17H19NO4
- Molecular Weight
- 301.1300
- Inchikey
- VHRSWCTVFBWHKE-UHFFFAOYSA-N
- Inchi
- InChI=1S/C17H19NO4/c1-18-5-4-11-8-16(21)17(22)9-12(11)13(18)6-10-2-3-14(19)15(20)7-10/h2-3,7-9,13,19-22H,4-6H2,1H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.4000
- Num H Donors
- 4
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 84.2000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Laudanosoline
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
Laudanosoline
Itcmdb Generated
ITX-INGREDIENT-66726F360DAE
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
301.130
Molecular Formula
C17H19NO4
Fda Maximum Daily Dose (Fdamdd)
0.920
Quantitative Estimate Of Drug Likeness（Qed）
0.640