Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 70627
- Core Entity Id
- 133276
- Source Entity Count
- 1
- Preferred Name
- cannabispiran
- Name En
- Pubchem Id
- 162936
- Smiles Canonical
- COC1=CC2=C(C(=C1)O)C3(CCC(=O)CC3)CC2
- Molecular Formula
- C15H18O3
- Molecular Weight
- 246.1300
- Inchikey
- WSWHSHJDUZRVPR-UHFFFAOYSA-N
- Inchi
- InChI=1S/C15H18O3/c1-18-12-8-10-2-5-15(14(10)13(17)9-12)6-3-11(16)4-7-15/h8-9,17H,2-7H2,1H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.3000
- Num H Donors
- 1
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 1
- Drug Likeness
- Polar Surface Area
- 46.5000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
cannabispiran
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
cannabispiran
Itcmdb Generated
ITX-INGREDIENT-340725148225
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
246.130
Molecular Formula
C15H18O3
Fda Maximum Daily Dose (Fdamdd)
0.794
Quantitative Estimate Of Drug Likeness（Qed）
0.828