IngredientID 65509
(3r,5s)-3,5-diacetoxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptane
C25H32O8
Relationship Network
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Herb: 1Ingredient: 1Target: 3Links: 7
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Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 65509
- Core Entity Id
- 128158
- Source Entity Count
- 1
- Preferred Name
- (3r,5s)-3,5-diacetoxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptane
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C25H32O8
- Molecular Weight
- 460.2100
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- Num H Donors
- Num H Acceptors
- Num Rotatable Bonds
- Drug Likeness
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
(3r,5s)-3,5-diacetoxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptane
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
(3r,5s)-3,5-diacetoxy-1,7-bis(4-hydroxy-3-methoxyphenyl)heptane
Itcmdb Generated
ITX-INGREDIENT-4E820F52D489
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
460.210
Molecular Formula
C25H32O8
Fda Maximum Daily Dose (Fdamdd)
0.976
Quantitative Estimate Of Drug Likeness（Qed）
0.458