Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 2Ingredient: 1Target: 2Links: 4
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 10753
- Core Entity Id
- 15114
- Source Entity Count
- 1
- Preferred Name
- Anemarans a,b,c,d
- Name En
- Pubchem Id
- 24726
- Smiles Canonical
- C(C=CCl)Cl
- Molecular Formula
- C3H4Cl2
- Molecular Weight
- 110.9710
- Inchikey
- UOORRWUZONOOLO-OWOJBTEDSA-N
- Inchi
- InChI=1S/C3H4Cl2/c4-2-1-3-5/h1-2H,3H2/b2-1+
- Isomeric Smiles
- C(/C=C/Cl)Cl
- Cas Id
- Ob Score
- Mol Logp
- 1.9777
- Num H Donors
- 0
- Num H Acceptors
- 0
- Num Rotatable Bonds
- 1
- Drug Likeness
- 0.4540
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Anemarans A, B, C, D
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Anemarans A, B, C, D
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Anemarans a,b,c,d
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Anemarans a,b,c,d
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
anemarans a, b, c, d
Role
preferred
Source
TCMBank
Preferred
Yes
Name
(E)-1,3-Dichloro-1-propene
Role
alias
Source
itcmdb_public
Preferred
No
Name
(E)-1,3-Dichloro-1-propene
Role
alias
Source
HERB_v2
Preferred
No
Name
(E)-1,3-Dichloropropene
Role
alias
Source
itcmdb_public
Preferred
No
Name
(E)-1,3-Dichloropropene
Role
alias
Source
HERB_v2
Preferred
No
Name
(E)-1,3-dichloroprop-1-ene
Role
alias
Source
HERB_v2
Preferred
No
Name
(E)-1,3-dichloroprop-1-ene
Role
alias
Source
itcmdb_public
Preferred
No
Name
1,3-Dichloropropylene
Role
alias
Source
itcmdb_public
Preferred
No
Name
1,3-Dichloropropylene
Role
alias
Source
HERB_v2
Preferred
No
Name
10061-02-6
Role
alias
Source
HERB_v2
Preferred
No
Name
10061-02-6
Role
alias
Source
itcmdb_public
Preferred
No
Name
3-Chloroallyl chloride
Role
alias
Source
itcmdb_public
Preferred
No
Name
3-Chloroallyl chloride
Role
alias
Source
HERB_v2
Preferred
No
Name
Telone
Role
alias
Source
HERB_v2
Preferred
No
Name
Telone
Role
alias
Source
itcmdb_public
Preferred
No
Name
Telone II
Role
alias
Source
itcmdb_public
Preferred
No
Name
Telone II
Role
alias
Source
HERB_v2
Preferred
No
Name
trans-1,3-Dichloro-1-propene
Role
alias
Source
HERB_v2
Preferred
No
Name
trans-1,3-Dichloro-1-propene
Role
alias
Source
itcmdb_public
Preferred
No
Name
trans-1,3-Dichloropropene
Role
alias
Source
HERB_v2
Preferred
No
Name
trans-1,3-Dichloropropene
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
Anemarans A, B, C, D(E)-1,3-Dichloro-1-propene(E)-1,3-Dichloropropene(E)-1,3-dichloroprop-1-ene1,3-Dichloropropylene10061-02-63-Chloroallyl chlorideTeloneTelone IItrans-1,3-Dichloro-1-propenetrans-1,3-Dichloropropene
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN016040
Npass
NPC223400
Tcmid
24962
Sym Map
SMIT18742
Pub Chem
24726
Tcmbank
TCMBANKIN003927
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C3H4Cl2/c4-2-1-3-5/h1-2H,3H2/b2-1+
Mol Wt
110.971
Smiles
C(C=CCl)Cl
Mol Log P
1.9777
Version
v1,v2
In Ch Ikey
UOORRWUZONOOLO-OWOJBTEDSA-N
Suppress
0
Num Hdonors
0
Drug Likeness
0.454
Num Hacceptors
0
Isomeric Smiles
C(/C=C/Cl)Cl
Canonical Smiles
C(C=CCl)Cl
Herb Alias Names
(E)-1,3-Dichloro-1-propene(E)-1,3-Dichloropropene10061-02-6trans-1,3-Dichloro-1-propenetrans-1,3-DichloropropeneTelone II1,3-DichloropropyleneTelone3-Chloroallyl chloride(E)-1,3-dichloroprop-1-ene
Molecular Formula
C3H4Cl2
Num Rotatable Bonds
1