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: 1Target: 10Links: 14
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 30555
- Core Entity Id
- 37149
- Source Entity Count
- 1
- Preferred Name
- Pranferol
- Name En
- Pubchem Id
- 159751
- Smiles Canonical
- CC(C)C(COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O
- Molecular Formula
- C16H16O5
- Molecular Weight
- 288.2990
- Inchikey
- JZRGHDSNRVNBNT-LBPRGKRZSA-N
- Inchi
- InChI=1S/C16H16O5/c1-9(2)12(17)8-20-16-10-3-4-15(18)21-14(10)7-13-11(16)5-6-19-13/h3-7,9,12,17H,8H2,1-2H3/t12-/m0/s1
- Isomeric Smiles
- CC(C)[C@H](COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O
- Cas Id
- 14685-06-4
- Ob Score
- 38.2939
- Mol Logp
- 2.9349
- Num H Donors
- 1
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 4
- Drug Likeness
- 0.7470
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Pranferol
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Pranferol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Pranferol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Pranferol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Pranferol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Pranferol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
14685-06-4
Role
alias
Source
itcmdb_public
Preferred
No
Name
14685-06-4
Role
alias
Source
HERB_v2
Preferred
No
Name
14685-06-4
Role
alias
Source
TCMBank
Preferred
No
Name
4-((2R)-2-hydroxy-3-methylbutoxy)furo(3,2-g)chromen-7-one
Role
alias
Source
itcmdb_public
Preferred
No
Name
4-[(2R)-2-hydroxy-3-methyl-butoxy]furo[3,2-g]chromen-7-one
Role
alias
Source
TCMBank
Preferred
No
Name
4-[(2R)-2-hydroxy-3-methylbutoxy]-7-furo[3,2-g]chromenone
Role
alias
Source
TCMBank
Preferred
No
Name
4-[(2R)-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one
Role
alias
Source
HERB_v2
Preferred
No
Name
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2-hydroxy-3-methylbutoxy)-, (-)-
Role
alias
Source
itcmdb_public
Preferred
No
Name
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2-hydroxy-3-methylbutoxy)-, (-)-
Role
alias
Source
TCMBank
Preferred
No
Name
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2-hydroxy-3-methylbutoxy)-, (-)-
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXCID4086016
Role
alias
Source
itcmdb_public
Preferred
No
Name
DTXCID4086016
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXSID20163525
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXSID20163525
Role
alias
Source
itcmdb_public
Preferred
No
Name
XP163687
Role
alias
Source
itcmdb_public
Preferred
No
Name
XP163687
Role
alias
Source
HERB_v2
Preferred
No
Aliases
Additional names normalized into the restored final schema.
14685-06-44-((2R)-2-hydroxy-3-methylbutoxy)furo(3,2-g)chromen-7-one4-[(2R)-2-hydroxy-3-methyl-butoxy]furo[3,2-g]chromen-7-one4-[(2R)-2-hydroxy-3-methylbutoxy]-7-furo[3,2-g]chromenone4-[(2R)-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2-hydroxy-3-methylbutoxy)-, (-)-DTXCID4086016DTXSID20163525XP163687
Cross References
Trusted external identifiers retained for this final record.
Cas
14685-06-4
Herb
HBIN040653
Tcmsp
MOL013332
Sym Map
SMIT13996
Pub Chem
159751
Tcmbank
TCMBANKIN004202
Etcm Ingredient
Pranferol
Itcmdb Generated
ITX-INGREDIENT-482BBB0F9E4D
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C16H16O5/c1-9(2)12(17)8-20-16-10-3-4-15(18)21-14(10)7-13-11(16)5-6-19-13/h3-7,9,12,17H,8H2,1-2H3/t12-/m0/s1
Mol Wt
288.299
Cas Id
14685-06-4
Smiles
CC(C)C(COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O
Mol Log P
2.934900000000001
Version
v1,v2
In Ch Ikey
JZRGHDSNRVNBNT-LBPRGKRZSA-N
Ob Score
38.29393538.2939353738.294
Suppress
0
Num Hdonors
1
Drug Likeness
0.747
Num Hacceptors
5
Isomeric Smiles
CC(C)[C@H](COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O
Molecule Weight
288.32
Canonical Smiles
CC(C)C(COC1=C2C=CC(=O)OC2=CC3=C1C=CO3)O
Herb Alias Names
14685-06-44-[(2R)-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-oneDTXSID201635257H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2-hydroxy-3-methylbutoxy)-, (-)-4-((2R)-2-hydroxy-3-methylbutoxy)furo(3,2-g)chromen-7-oneDTXCID4086016XP163687
Molecular Weight
288.100
Molecular Weight
288.3
Molecular Formula
C16H16O5
Molecular Formula
C16H16O5
Molecular Formula
C16H16O5
Num Rotatable Bonds
4
Fda Maximum Daily Dose (Fdamdd)
0.135
Quantitative Estimate Of Drug Likeness（Qed）
0.747