IngredientID 6952
5-hydroxy-2,8,6-trimethyl-8-(3,7-dimethyl-2,6-octadienyl)-2h-1-betzopyran-4,7(3h,8h)-dione
C22H30O4
Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 6952
- Core Entity Id
- 10908
- Source Entity Count
- 1
- Preferred Name
- 5-hydroxy-2,8,6-trimethyl-8-(3,7-dimethyl-2,6-octadienyl)-2h-1-betzopyran-4,7(3h,8h)-dione
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C22H30O4
- Molecular Weight
- 358.2100
- 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
5-Hydroxy-2,8,6-trimethyl-8-(3,7-dimethyl-2,6-octadienyl)-2H-1-betzopyran-4,7(3H,8H)-dione
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
5-hydroxy-2,8,6-trimethyl-8-(3,7-dimethyl-2,6-octadienyl)-2h-1-betzopyran-4,7(3h,8h)-dione
Role
preferred
Source
TCMBank
Preferred
Yes
Name
5-hydroxy-2,8,6-trimethyl-8-(3,7-dimethyl-2,6-octadienyl)-2h-1-betzopyran-4,7(3h,8h)-dione
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
5-hydroxy-2,8,6-trimethyl-8-(3,7-dimethyl-2,6-octadienyl)-2h-1-betzopyran-4,7(3h,8h)-dione
Role
preferred
Source
itcmdb_public
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN011588
Tcmid
31284
Tcmbank
TCMBANKIN048153
Etcm Ingredient
5-Hydroxy-2,8,6-trimethyl-8-(3,7-dimethyl-2,6-octadienyl)-2H-1-betzopyran-4,7(3H,8H)-dione
Itcmdb Generated
ITX-INGREDIENT-54E79F7ECBCE
Attributes
Merged source attributes and domain-specific metadata.
Mol2 Path
/TCM_database/2003_3d_all/4200.mol2
Reference
755
Molecular Weight
358.210
Molecular Formula
C22H30O4
Molecular Formula
C22H30O4
Molecular Formula
C22H30O4
Fda Maximum Daily Dose (Fdamdd)
0.174
Quantitative Estimate Of Drug Likeness（Qed）
0.412