IngredientID 65110
(+)-(7S,8S)-1',4-di-hydroxy-3,3',5'-trimethoxy-7',8',9'-trinor-8,4'-oxyneoligna-7,9-diol
C18H22O8
Relationship Network
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Herb: 1Ingredient: 1Target: 2Links: 5
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Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 65110
- Core Entity Id
- 127759
- Source Entity Count
- 1
- Preferred Name
- (+)-(7S,8S)-1',4-di-hydroxy-3,3',5'-trimethoxy-7',8',9'-trinor-8,4'-oxyneoligna-7,9-diol
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C18H22O8
- Molecular Weight
- 366.1300
- 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
(+)-(7S,8S)-1',4-di-hydroxy-3,3',5'-trimethoxy-7',8',9'-trinor-8,4'-oxyneoligna-7,9-diol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
(+)-(7S,8S)-1',4-di-hydroxy-3,3',5'-trimethoxy-7',8',9'-trinor-8,4'-oxyneoligna-7,9-diol
Itcmdb Generated
ITX-INGREDIENT-0FA68DA41FF1
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
366.130
Molecular Formula
C18H22O8
Fda Maximum Daily Dose (Fdamdd)
0.135
Quantitative Estimate Of Drug Likeness(Qed)
0.556