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
- 66052
- Core Entity Id
- 128701
- Source Entity Count
- 1
- Preferred Name
- 1,3,5-cadinatriene-3,8-diol
- Name En
- Pubchem Id
- 74051580
- Smiles Canonical
- CC1CC(C(C2=C1C=C(C(=C2)C)O)C(C)C)O
- Molecular Formula
- C15H22O2
- Molecular Weight
- 234.1600
- Inchikey
- RKVZRTDMSVXBGL-UHFFFAOYSA-N
- Inchi
- InChI=1S/C15H22O2/c1-8(2)15-12-5-10(4)13(16)7-11(12)9(3)6-14(15)17/h5,7-9,14-17H,6H2,1-4H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 3.4000
- Num H Donors
- 2
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 1
- Drug Likeness
- Polar Surface Area
- 40.5000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
1,3,5-cadinatriene-3,8-diol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
1,3,5-cadinatriene-3,8-diol
Itcmdb Generated
ITX-INGREDIENT-2FA62A25E5C9
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
234.160
Molecular Formula
C15H22O2
Fda Maximum Daily Dose (Fdamdd)
0.965
Quantitative Estimate Of Drug Likeness（Qed）
0.782