Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 37653
- Core Entity Id
- 57481
- Source Entity Count
- 1
- Preferred Name
- 1,19-eicosadiene
- Name En
- Pubchem Id
- 519006
- Smiles Canonical
- C=CCCCCCCCCCCCCCCCCC=C
- Molecular Formula
- C20H38
- Molecular Weight
- 278.5240
- Inchikey
- AWJFCAXSGQLCKK-UHFFFAOYSA-N
- Inchi
- InChI=1S/C20H38/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-4H,1-2,5-20H2
- Isomeric Smiles
- C=CCCCCCCCCCCCCCCCCC=C
- Cas Id
- Ob Score
- Mol Logp
- 7.6000
- Num H Donors
- 0
- Num H Acceptors
- 0
- Num Rotatable Bonds
- 17
- Drug Likeness
- 0.1900
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
1,19-eicosadiene
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
1,19-eicosadiene
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
1,19-eicosadiene
Role
preferred
Source
TCMBank
Preferred
Yes
Name
1 19-EICOSADIENE
Role
alias
Source
HERB_v2
Preferred
No
Name
1 19-EICOSADIENE
Role
alias
Source
itcmdb_public
Preferred
No
Name
1,19-Icosadiene
Role
alias
Source
HERB_v2
Preferred
No
Name
1,19-Icosadiene #
Role
alias
Source
itcmdb_public
Preferred
No
Name
14811-95-1
Role
alias
Source
HERB_v2
Preferred
No
Name
14811-95-1
Role
alias
Source
itcmdb_public
Preferred
No
Name
8MZ9N8W9QS
Role
alias
Source
HERB_v2
Preferred
No
Name
8MZ9N8W9QS
Role
alias
Source
itcmdb_public
Preferred
No
Name
DTXCID80284962
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXCID80284962
Role
alias
Source
itcmdb_public
Preferred
No
Name
DTXSID70333872
Role
alias
Source
itcmdb_public
Preferred
No
Name
DTXSID70333872
Role
alias
Source
HERB_v2
Preferred
No
Name
UNII-8MZ9N8W9QS
Role
alias
Source
HERB_v2
Preferred
No
Name
UNII-8MZ9N8W9QS
Role
alias
Source
itcmdb_public
Preferred
No
Name
icosa-1,19-diene
Role
alias
Source
HERB_v2
Preferred
No
Name
icosa-1,19-diene
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
1 19-EICOSADIENE1,19-Icosadiene1,19-Icosadiene #14811-95-18MZ9N8W9QSDTXCID80284962DTXSID70333872UNII-8MZ9N8W9QSicosa-1,19-diene
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN000333
Npass
NPC199137
Tcmid
40777
Pub Chem
519006
Tcmbank
TCMBANKIN035684
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C20H38/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-4H,1-2,5-20H2
Mol Wt
278.5239999999999
Smiles
C=CCCCCCCCCCCCCCCCCC=C
Mol Log P
7.600000000000007
In Ch Ikey
AWJFCAXSGQLCKK-UHFFFAOYSA-N
Num Hdonors
0
Drug Likeness
0.19
Num Hacceptors
0
Isomeric Smiles
C=CCCCCCCCCCCCCCCCCC=C
Canonical Smiles
C=CCCCCCCCCCCCCCCCCC=C
Herb Alias Names
14811-95-1icosa-1,19-diene8MZ9N8W9QS1 19-EICOSADIENEDTXSID703338721,19-Icosadiene1,19-Icosadiene #UNII-8MZ9N8W9QSDTXCID80284962
Molecular Weight
278.5 g/mol
Molecular Formula
C20H38
Molecular Formula
C20H38
Num Rotatable Bonds
17