Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Herb: 5Ingredient: 1Target: 3Links: 8
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 36213
- Core Entity Id
- 43443
- Source Entity Count
- 1
- Preferred Name
- Usaf hc-1
- Name En
- Pubchem Id
- 5192
- Smiles Canonical
- C(CCCCC(=O)O)CCCC(=O)O
- Molecular Formula
- C10H18O4
- Molecular Weight
- 202.2500
- Inchikey
- CXMXRPHRNRROMY-UHFFFAOYSA-N
- Inchi
- InChI=1S/C10H18O4/c11-9(12)7-5-3-1-2-4-6-8-10(13)14/h1-8H2,(H,11,12)(H,13,14)
- Isomeric Smiles
- C(CCCCC(=O)O)CCCC(=O)O
- Cas Id
- 32734-00-2
- Ob Score
- 16.2250
- Mol Logp
- 2.2764
- Num H Donors
- 2
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 9
- Drug Likeness
- 0.5620
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Usaf Hc-1
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Usaf hc-1
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Usaf hc-1
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
1,10-Decanedioic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
1,10-Decanedioic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
1,8-Octanedicarboxylic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
1,8-Octanedicarboxylic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
111-20-6
Role
alias
Source
itcmdb_public
Preferred
No
Name
111-20-6
Role
alias
Source
HERB_v2
Preferred
No
Name
Acide sebacique
Role
alias
Source
itcmdb_public
Preferred
No
Name
Acide sebacique
Role
alias
Source
HERB_v2
Preferred
No
Name
DECANEDIOIC ACID
Role
alias
Source
HERB_v2
Preferred
No
Name
DECANEDIOIC ACID
Role
alias
Source
itcmdb_public
Preferred
No
Name
Decanedicarboxylic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
Decanedicarboxylic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
Sebacinsaeure
Role
alias
Source
itcmdb_public
Preferred
No
Name
Sebacinsaeure
Role
alias
Source
HERB_v2
Preferred
No
Name
Sebacinsaure
Role
alias
Source
itcmdb_public
Preferred
No
Name
Sebacinsaure
Role
alias
Source
HERB_v2
Preferred
No
Name
n-Decanedioic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
n-Decanedioic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
sebacic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
sebacic acid
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
1,10-Decanedioic acid1,8-Octanedicarboxylic acid111-20-6Acide sebaciqueDECANEDIOIC ACIDDecanedicarboxylic acidSebacinsaeureSebacinsauren-Decanedioic acidsebacic acid
Cross References
Trusted external identifiers retained for this final record.
Cas
32734-00-2
Herb
HBIN047627
Npass
NPC118968
Tcmid
33145
Tcmsp
MOL001302
Sym Map
SMIT03746
Pub Chem
5192
Drug Bank
DB07645
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C10H18O4/c11-9(12)7-5-3-1-2-4-6-8-10(13)14/h1-8H2,(H,11,12)(H,13,14)
Mol Wt
202.2499999999999
Cas Id
32734-00-2
Mol Log P
2.2764
Version
v1,v2
In Ch Ikey
CXMXRPHRNRROMY-UHFFFAOYSA-N
Ob Score
16.22516.2251978
Suppress
0
Num Hdonors
2
Drug Likeness
0.562
Num Hacceptors
2
Isomeric Smiles
C(CCCCC(=O)O)CCCC(=O)O
Molecule Weight
202.28
Canonical Smiles
C(CCCCC(=O)O)CCCC(=O)O
Herb Alias Names
sebacic acidDECANEDIOIC ACID111-20-61,8-Octanedicarboxylic acid1,10-Decanedioic acidSebacinsaureDecanedicarboxylic acidn-Decanedioic acidAcide sebaciqueSebacinsaeure
Molecular Formula
C10H18O4
Num Rotatable Bonds
9