IngredientID 18665

Ethosuximide

C7H11NO2

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Herb: 1Ingredient: 1Target: 12Links: 13
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
18665
Core Entity Id
23924
Source Entity Count
1
Preferred Name
Ethosuximide
Name En
Pubchem Id
3291
Smiles Canonical
CCC1(CC(=O)NC1=O)C
Molecular Formula
C7H11NO2
Molecular Weight
141.1700
Inchikey
HAPOVYFOVVWLRS-UHFFFAOYSA-N
Inchi
InChI=1S/C7H11NO2/c1-3-7(2)4-5(9)8-6(7)10/h3-4H2,1-2H3,(H,8,9,10)
Isomeric Smiles
CCC1(CC(=O)NC1=O)C
Cas Id
Ob Score
Mol Logp
0.4492
Num H Donors
1
Num H Acceptors
2
Num Rotatable Bonds
1
Drug Likeness
0.5390
Polar Surface Area
Molecular Volume
Alogp

Names

Preferred names, aliases, and source labels retained in the final schema.

Name
Ethosuximide
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Ethosuximide
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Ethosuximide
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
2-Ethyl-2-methylsuccinimide
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-Ethyl-2-methylsuccinimide
Role
alias
Source
HERB_v2
Preferred
No
Name
77-67-8
Role
alias
Source
itcmdb_public
Preferred
No
Name
77-67-8
Role
alias
Source
HERB_v2
Preferred
No
Name
Atysmal
Role
alias
Source
itcmdb_public
Preferred
No
Name
Atysmal
Role
alias
Source
HERB_v2
Preferred
No
Name
Ethosuccimide
Role
alias
Source
HERB_v2
Preferred
No
Name
Ethosuccimide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Ethosuccinimide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Ethosuccinimide
Role
alias
Source
HERB_v2
Preferred
No
Name
Ethosuxide
Role
alias
Source
HERB_v2
Preferred
No
Name
Ethosuxide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Etosuximida
Role
alias
Source
itcmdb_public
Preferred
No
Name
Etosuximida
Role
alias
Source
HERB_v2
Preferred
No
Name
Pyknolepsinum
Role
alias
Source
itcmdb_public
Preferred
No
Name
Pyknolepsinum
Role
alias
Source
HERB_v2
Preferred
No
Name
Zarontin
Role
alias
Source
HERB_v2
Preferred
No
Name
Zarontin
Role
alias
Source
itcmdb_public
Preferred
No

Aliases

Additional names normalized into the restored final schema.

2-Ethyl-2-methylsuccinimide77-67-8AtysmalEthosuccimideEthosuccinimideEthosuxideEtosuximidaPyknolepsinumZarontin

Cross References

Trusted external identifiers retained for this final record.

Herb
HBIN025843
Npass
NPC21142
Tcmid
32980
Pub Chem
3291
Tcmbank
TCMBANKIN034839

Attributes

Merged source attributes and domain-specific metadata.

In Ch I
InChI=1S/C7H11NO2/c1-3-7(2)4-5(9)8-6(7)10/h3-4H2,1-2H3,(H,8,9,10)
Mol Wt
141.17
Smiles
CCC1(CC(=O)NC1=O)C
Mol Log P
0.4492
In Ch Ikey
HAPOVYFOVVWLRS-UHFFFAOYSA-N
Num Hdonors
1
Drug Likeness
0.539
Num Hacceptors
2
Isomeric Smiles
CCC1(CC(=O)NC1=O)C
Canonical Smiles
CCC1(CC(=O)NC1=O)C
Herb Alias Names
77-67-8ZarontinEthosuxideEtosuximidaPyknolepsinum2-Ethyl-2-methylsuccinimideEthosuccimideEthosuccinimideAtysmal
Molecular Weight
141.17 g/mol
Molecular Formula
C7H11NO2
Molecular Formula
C7H11NO2
Num Rotatable Bonds
1