Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 3Ingredient: 1Target: 12Links: 15
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 6998
- Core Entity Id
- 10960
- Source Entity Count
- 1
- Preferred Name
- 5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromone
- Name En
- Pubchem Id
- 10970376
- Smiles Canonical
- COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C(=C3)OC)OC)OC)O
- Molecular Formula
- C19H18O7
- Molecular Weight
- 358.3460
- Inchikey
- FLCVGMVLNHYJAW-UHFFFAOYSA-N
- Inchi
- InChI=1S/C19H18O7/c1-22-11-7-12(20)18-13(21)9-14(26-15(18)8-11)10-5-16(23-2)19(25-4)17(6-10)24-3/h5-9,20H,1-4H3
- Isomeric Smiles
- COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C(=C3)OC)OC)OC)O
- Cas Id
- 18103-41-8
- Ob Score
- 51.9565
- Mol Logp
- 3.2000
- Num H Donors
- 1
- Num H Acceptors
- 7
- Num Rotatable Bonds
- 5
- Drug Likeness
- 0.7490
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
5-Hydroxy-7-Methoxy-2-(3,4,5-Trimethoxyphenyl)Chromone
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromone
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromone
Role
preferred
Source
TCMBank
Preferred
Yes
Name
5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromone
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
18103-41-8
Role
alias
Source
HERB_v2
Preferred
No
Name
18103-41-8
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-(3,4,5-Trimethoxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one
Role
alias
Source
HERB_v2
Preferred
No
Name
2-(3,4,5-Trimethoxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-Hydroxy-3',4',5',7-tetramethoxyflavone
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-Hydroxy-3',4',5',7-tetramethoxyflavone
Role
alias
Source
HERB_v2
Preferred
No
Name
5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)-4-chromenone
Role
alias
Source
TCMBank
Preferred
No
Name
5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one
Role
alias
Source
HERB_v2
Preferred
No
Name
5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one
Role
alias
Source
TCMBank
Preferred
No
Name
CHEMBL511257
Role
alias
Source
HERB_v2
Preferred
No
Name
CHEMBL511257
Role
alias
Source
itcmdb_public
Preferred
No
Name
Corymbosin
Role
alias
Source
HERB_v2
Preferred
No
Name
Corymbosin
Role
alias
Source
itcmdb_public
Preferred
No
Name
DTXSID701347298
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXSID701347298
Role
alias
Source
itcmdb_public
Preferred
No
Name
FLCVGMVLNHYJAW-UHFFFAOYSA-N
Role
alias
Source
HERB_v2
Preferred
No
Name
FLCVGMVLNHYJAW-UHFFFAOYSA-N
Role
alias
Source
itcmdb_public
Preferred
No
Name
HY-N7329
Role
alias
Source
HERB_v2
Preferred
No
Name
HY-N7329
Role
alias
Source
itcmdb_public
Preferred
No
Name
SCHEMBL1976826
Role
alias
Source
HERB_v2
Preferred
No
Name
SCHEMBL1976826
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-Hydroxy-7,3',4',5'-Tetramethoxyflavone
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
5-hydroxy-7,3',4',5'-tetramethoxyflavone
Role
preferred
Source
TCMBank
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
18103-41-82-(3,4,5-Trimethoxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one5-Hydroxy-3',4',5',7-tetramethoxyflavone5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)-4-chromenone5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-oneCHEMBL511257CorymbosinDTXSID701347298FLCVGMVLNHYJAW-UHFFFAOYSA-NHY-N7329SCHEMBL19768265-Hydroxy-7,3',4',5'-Tetramethoxyflavone
Cross References
Trusted external identifiers retained for this final record.
Cas
18103-41-8
Herb
HBIN011654HBIN011637
Npass
NPC33265
Tcmid
402144130243008
Tcmsp
MOL003095
Sym Map
SMIT05229SMIT21714
Pub Chem
10970376
Tcmbank
TCMBANKIN023615TCMBANKIN061725
Etcm Ingredient
5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromone
Itcmdb Generated
ITX-INGREDIENT-C069275E6753ITX-INGREDIENT-CCC8225DDB53
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C19H18O7/c1-22-11-7-12(20)18-13(21)9-14(26-15(18)8-11)10-5-16(23-2)19(25-4)17(6-10)24-3/h5-9,20H,1-4H3
Mol Wt
358.3460000000001
Cas Id
18103-41-8
Smiles
COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C(=C3)OC)OC)OC)O
Mol Log P
3.200000000000002
Version
v1,v2
In Ch Ikey
FLCVGMVLNHYJAW-UHFFFAOYSA-N
Ob Score
51.95651351.9565134551.957
Suppress
0
Num Hdonors
1
Drug Likeness
0.749
Num Hacceptors
7
Isomeric Smiles
COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C(=C3)OC)OC)OC)O
Molecule Weight
358.37
Canonical Smiles
COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C(=C3)OC)OC)OC)O
Herb Alias Names
Corymbosin18103-41-82-(3,4,5-Trimethoxyphenyl)-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one5-hydroxy-7-methoxy-2-(3,4,5-trimethoxyphenyl)chromen-4-one5-Hydroxy-3',4',5',7-tetramethoxyflavoneCHEMBL511257SCHEMBL1976826FLCVGMVLNHYJAW-UHFFFAOYSA-NDTXSID701347298HY-N7329
Molecular Weight
358.110
Molecular Weight
358.34
Molecular Formula
C19H18O7
Molecular Formula
C19H18O7
Molecular Formula
C19H18O7
Num Rotatable Bonds
5
Fda Maximum Daily Dose (Fdamdd)
0.456
Quantitative Estimate Of Drug Likeness（Qed）
0.749