Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Trial: 9Herb: 2Ingredient: 1Meta-analysis: 3Target: 12Links: 26
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 24798
- Core Entity Id
- 30757
- Source Entity Count
- 1
- Preferred Name
- Lucidol
- Name En
- Pubchem Id
- 7187
- Smiles Canonical
- C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2
- Molecular Formula
- C14H10O4
- Molecular Weight
- 242.2300
- Inchikey
- OMPJBNCRMGITSC-UHFFFAOYSA-N
- Inchi
- InChI=1S/C14H10O4/c15-13(11-7-3-1-4-8-11)17-18-14(16)12-9-5-2-6-10-12/h1-10H
- Isomeric Smiles
- C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2
- Cas Id
- Ob Score
- Mol Logp
- 2.6154
- Num H Donors
- 0
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 2
- Drug Likeness
- 0.6000
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Lucidol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Lucidol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
lucidol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
94-36-0
Role
alias
Source
HERB_v2
Preferred
No
Name
94-36-0
Role
alias
Source
itcmdb_public
Preferred
No
Name
Acetoxyl
Role
alias
Source
itcmdb_public
Preferred
No
Name
Acetoxyl
Role
alias
Source
HERB_v2
Preferred
No
Name
BENZOYL PEROXIDE
Role
alias
Source
itcmdb_public
Preferred
No
Name
BENZOYL PEROXIDE
Role
alias
Source
HERB_v2
Preferred
No
Name
Benoxyl
Role
alias
Source
HERB_v2
Preferred
No
Name
Benoxyl
Role
alias
Source
itcmdb_public
Preferred
No
Name
Benzoperoxide
Role
alias
Source
HERB_v2
Preferred
No
Name
Benzoperoxide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Benzoyl superoxide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Benzoyl superoxide
Role
alias
Source
HERB_v2
Preferred
No
Name
Dibenzoyl peroxide
Role
alias
Source
HERB_v2
Preferred
No
Name
Dibenzoyl peroxide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Oxylite
Role
alias
Source
HERB_v2
Preferred
No
Name
Oxylite
Role
alias
Source
itcmdb_public
Preferred
No
Name
Peroxide, dibenzoyl
Role
alias
Source
HERB_v2
Preferred
No
Name
Peroxide, dibenzoyl
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
94-36-0AcetoxylBENZOYL PEROXIDEBenoxylBenzoperoxideBenzoyl superoxideDibenzoyl peroxideOxylitePeroxide, dibenzoyl
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN033663
Npass
NPC261181
Tcmid
13041
Pub Chem
7187
Tcmbank
TCMBANKIN013088
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C14H10O4/c15-13(11-7-3-1-4-8-11)17-18-14(16)12-9-5-2-6-10-12/h1-10H
Mol Wt
242.23
Smiles
C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2
Mol Log P
2.615400000000001
In Ch Ikey
OMPJBNCRMGITSC-UHFFFAOYSA-N
Num Hdonors
0
Drug Likeness
0.6
Num Hacceptors
4
Isomeric Smiles
C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2
Canonical Smiles
C1=CC=C(C=C1)C(=O)OOC(=O)C2=CC=CC=C2
Herb Alias Names
BENZOYL PEROXIDE94-36-0Peroxide, dibenzoylDibenzoyl peroxideBenzoyl superoxideBenzoperoxideBenoxylAcetoxylOxylite
Molecular Weight
242.23 g/mol
Molecular Formula
C14H10O4
Molecular Formula
C14H10O4
Num Rotatable Bonds
2