Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 2Links: 5
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 65041
- Core Entity Id
- 127690
- Source Entity Count
- 1
- Preferred Name
- (-)-a-Cadinene
- Name En
- Pubchem Id
- 12306048
- Smiles Canonical
- CC1=CC2C(CC1)C(=CCC2C(C)C)C
- Molecular Formula
- C15H24
- Molecular Weight
- 204.1900
- Inchikey
- QMAYBMKBYCGXDH-KKUMJFAQSA-N
- Inchi
- InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h6,9-10,13-15H,5,7-8H2,1-4H3/t13-,14-,15-/m0/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 4.1000
- Num H Donors
- 0
- Num H Acceptors
- 0
- Num Rotatable Bonds
- 1
- Drug Likeness
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
(-)-a-Cadinene
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
(-)-a-Cadinene
Itcmdb Generated
ITX-INGREDIENT-033599D30238
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
204.190
Molecular Formula
C15H24
Fda Maximum Daily Dose (Fdamdd)
0.052
Quantitative Estimate Of Drug Likeness（Qed）
0.548