Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 1Links: 3
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 72124
- Core Entity Id
- 134773
- Source Entity Count
- 1
- Preferred Name
- Furanoeremophilone
- Name En
- Pubchem Id
- 13819511
- Smiles Canonical
- CC1CCCC2C1(CC3=C(C2=O)OC=C3C)C
- Molecular Formula
- C15H20O2
- Molecular Weight
- 232.1500
- Inchikey
- KLLSQGNSOCVVAN-JVLSTEMRSA-N
- Inchi
- InChI=1S/C15H20O2/c1-9-8-17-14-11(9)7-15(3)10(2)5-4-6-12(15)13(14)16/h8,10,12H,4-7H2,1-3H3/t10-,12+,15+/m0/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 4.1000
- Num H Donors
- 0
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 0
- Drug Likeness
- Polar Surface Area
- 30.2000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Furanoeremophilone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
Furanoeremophilone
Itcmdb Generated
ITX-INGREDIENT-1E4462037EF4
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
232.150
Molecular Formula
C15H20O2
Fda Maximum Daily Dose (Fdamdd)
0.337
Quantitative Estimate Of Drug Likeness（Qed）
0.681