Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 6456
- Core Entity Id
- 10354
- Source Entity Count
- 1
- Preferred Name
- 5,2',6'-trihydrox y-7-methoxyflavone
- Name En
- Pubchem Id
- 10946502
- Smiles Canonical
- COC1=CC(=C2C(=C1)OC(=CC2=O)C3=C(C=CC=C3O)O)O
- Molecular Formula
- C16H12O6
- Molecular Weight
- 300.2660
- Inchikey
- UAAZSBRHWYSPEI-UHFFFAOYSA-N
- Inchi
- InChI=1S/C16H12O6/c1-21-8-5-11(19)16-12(20)7-14(22-13(16)6-8)15-9(17)3-2-4-10(15)18/h2-7,17-19H,1H3
- Isomeric Smiles
- COC1=CC(=C2C(=C1)OC(=CC2=O)C3=C(C=CC=C3O)O)O
- Cas Id
- Ob Score
- Mol Logp
- 2.5854
- Num H Donors
- 3
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 2
- Drug Likeness
- 0.6720
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
5,2',6'-Trihydrox Y-7-Methoxyflavone
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
5,2',6'-trihydrox y-7-methoxyflavone
Role
preferred
Source
TCMBank
Preferred
Yes
Name
5,2',6'-trihydrox y-7-methoxyflavone
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
5,2',6'-trihydrox y-7-methoxyflavone
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
2-(2,6-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one
Role
alias
Source
HERB_v2
Preferred
No
Name
2-(2,6-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one
Role
alias
Source
itcmdb_public
Preferred
No
Name
393825-50-8
Role
alias
Source
itcmdb_public
Preferred
No
Name
393825-50-8
Role
alias
Source
HERB_v2
Preferred
No
Name
5,2',6'-Trihydroxy-7-methoxyflavone
Role
alias
Source
itcmdb_public
Preferred
No
Name
5,2',6'-Trihydroxy-7-methoxyflavone
Role
alias
Source
HERB_v2
Preferred
No
Name
LMPK12110135
Role
alias
Source
HERB_v2
Preferred
No
Name
LMPK12110135
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
2-(2,6-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-one393825-50-85,2',6'-Trihydroxy-7-methoxyflavoneLMPK12110135
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN010977
Npass
NPC310647
Tcmid
21758
Sym Map
SMIT21604
Pub Chem
10946502
Tcmbank
TCMBANKIN021237
Itcmdb Generated
ITX-INGREDIENT-2C1C65804C08
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C16H12O6/c1-21-8-5-11(19)16-12(20)7-14(22-13(16)6-8)15-9(17)3-2-4-10(15)18/h2-7,17-19H,1H3
Mol Wt
300.266
Smiles
COC1=CC(=C2C(=C1)OC(=CC2=O)C3=C(C=CC=C3O)O)O
Mol Log P
2.585400000000002
Version
v2
In Ch Ikey
UAAZSBRHWYSPEI-UHFFFAOYSA-N
Suppress
0
Num Hdonors
3
Drug Likeness
0.672
Num Hacceptors
6
Isomeric Smiles
COC1=CC(=C2C(=C1)OC(=CC2=O)C3=C(C=CC=C3O)O)O
Canonical Smiles
COC1=CC(=C2C(=C1)OC(=CC2=O)C3=C(C=CC=C3O)O)O
Herb Alias Names
5,2',6'-Trihydroxy-7-methoxyflavone2-(2,6-dihydroxyphenyl)-5-hydroxy-7-methoxychromen-4-oneLMPK12110135393825-50-8
Molecular Weight
300.26 g/mol
Molecular Formula
C16H12O6
Molecular Formula
C16H12O6
Num Rotatable Bonds
2