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
- 65637
- Core Entity Id
- 128286
- Source Entity Count
- 1
- Preferred Name
- (7R,8S)-dehydrodiconiferyl alcohol
- Name En
- Pubchem Id
- 11078843
- Smiles Canonical
- COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)C=CCO
- Molecular Formula
- C20H22O6
- Molecular Weight
- 358.1400
- Inchikey
- KUSXBOZNRPQEON-GWKPYITFSA-N
- Inchi
- InChI=1S/C20H22O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h3-6,8-10,15,19,21-23H,7,11H2,1-2H3/b4-3+/t15-,19+/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 1.9000
- Num H Donors
- 3
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 6
- Drug Likeness
- Polar Surface Area
- 88.4000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
(7R,8S)-dehydrodiconiferyl alcohol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
(7R,8S)-dehydrodiconiferyl alcohol
Itcmdb Generated
ITX-INGREDIENT-7AB3008E08D7
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
358.140
Molecular Formula
C20H22O6
Fda Maximum Daily Dose (Fdamdd)
0.513
Quantitative Estimate Of Drug Likeness（Qed）
0.736