Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 3Ingredient: 1Target: 7Links: 11
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 37396
- Core Entity Id
- 56160
- Source Entity Count
- 1
- Preferred Name
- 10,13-eicosadienoic
- Name En
- Pubchem Id
- 549062
- Smiles Canonical
- Molecular Formula
- C20H36O2
- Molecular Weight
- 308.5600
- Inchikey
- KZPHKFAQEJZHNO-UHFFFAOYSA-N
- Inchi
- InChI=1S/C21H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h8-9,11-12H,3-7,10,13-20H2,1-2H3
- Isomeric Smiles
- Cas Id
- 30223-50-8
- Ob Score
- 39.9936
- Mol Logp
- 8.0000
- Num H Donors
- 0
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 17
- Drug Likeness
- Polar Surface Area
- 26.3000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
10,13-Eicosadienoic
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
10,13-Eicosadienoic
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
10,13-eicosadienoic
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
10,13-eicosadienoic
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
10,13-eicosadienoic
Role
preferred
Source
TCMBank
Preferred
Yes
Name
10,13-eicosadienoic
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Cas
30223-50-8
Herb
HBIN000017
Tcmsp
MOL006936
Sym Map
SMIT08473
Tcmbank
TCMBANKIN031124
Etcm Ingredient
10,13-eicosadienoic
Itcmdb Generated
ITX-INGREDIENT-7EA2AFAB576F
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Cas Id
30223-50-8
Version
v1,v2
Ob Score
39.99355439.9935540839.994
Suppress
0
Molecule Weight
308.56
Molecular Weight
308.270
Molecular Weight
308.56
Molecular Formula
C20H36O2
Fda Maximum Daily Dose (Fdamdd)
0.471
Quantitative Estimate Of Drug Likeness（Qed）
0.255