Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 2Ingredient: 1Links: 2
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 82
- Core Entity Id
- 858
- Source Entity Count
- 1
- Preferred Name
- 2-(1'-methylethenyl)-6-hydroxy-2,3-dihydro-benzo[ b]furan
- Name En
- Pubchem Id
- 10877664
- Smiles Canonical
- CC(=C)C1CC2=C(O1)C=C(C=C2)O
- Molecular Formula
- C11H12O2
- Molecular Weight
- 176.2150
- Inchikey
- NUDTXQJCDWVIJC-UHFFFAOYSA-N
- Inchi
- InChI=1S/C11H12O2/c1-7(2)10-5-8-3-4-9(12)6-11(8)13-10/h3-4,6,10,12H,1,5H2,2H3
- Isomeric Smiles
- CC(=C)C1CC2=C(O1)C=C(C=C2)O
- Cas Id
- Ob Score
- Mol Logp
- 2.2718
- Num H Donors
- 1
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 1
- Drug Likeness
- 0.6650
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2-(1'-Methylethenyl)-6-hydroxy-2,3-dihydrobenzo[b]furan
Role
preferred
Source
TCMBank
Preferred
Yes
Name
2-(1'-methylethenyl)-6-hydroxy-2,3-dihydro-benzo[ b]furan
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
2-(1'-methylethenyl)-6-hydroxy-2,3-dihydro-benzo[ b]furan
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
非州紫葳
Role
TCM_name
Source
TCMBank
Preferred
No
Name
FEI ZHOU ZI WEI
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Africa Trumpetcreeper*
Role
TCM_name_en
Source
TCMBank
Preferred
No
Name
wikstroemioidin c
Role
preferred
Source
TCMBank
Preferred
Yes
Name
荛花香茶菜
Role
TCM_name
Source
TCMBank
Preferred
No
Name
YAO HUA XIANG CHA CAI
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Stringbushlike Rabdosia
Role
TCM_name_en
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
2-(1'-Methylethenyl)-6-hydroxy-2,3-dihydrobenzo[b]furan非州紫葳FEI ZHOU ZI WEIAfrica Trumpetcreeper*wikstroemioidin c荛花香茶菜YAO HUA XIANG CHA CAIStringbushlike Rabdosia
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN003582HBIN048249
Tcmid
1442222655
Pub Chem
10877664
Tcmbank
TCMBANKIN002846TCMBANKIN013247TCMBANKIN058685
Itcmdb Generated
ITX-INGREDIENT-812DDCFDE6E8ITX-INGREDIENT-7403EC062612
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C11H12O2/c1-7(2)10-5-8-3-4-9(12)6-11(8)13-10/h3-4,6,10,12H,1,5H2,2H3
Mol Wt
176.215
Smiles
CC(=C)C1CC2=C(O1)C=C(C=C2)O
Mol Log P
2.2718
In Ch Ikey
NUDTXQJCDWVIJC-UHFFFAOYSA-N
Tcm Name
非州紫葳
Tcm Name2
FEI ZHOU ZI WEI
Mol2 Path
/TCM_database/2007_3d_all/14429.mol2
Reference
3442
Num Hdonors
1
Tcm Name En
Africa Trumpetcreeper*
Drug Likeness
0.665
Num Hacceptors
2
Isomeric Smiles
CC(=C)C1CC2=C(O1)C=C(C=C2)O
Canonical Smiles
CC(=C)C1CC2=C(O1)C=C(C=C2)O
Molecular Formula
C11H12O2
Molecular Formula
C11H12O2
Num Rotatable Bonds
1