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
- 32000
- Core Entity Id
- 38757
- Source Entity Count
- 1
- Preferred Name
- Rorifamide
- Name En
- Pubchem Id
- 154173
- Smiles Canonical
- CS(=O)(=O)CCCCCCCCCC(=O)N
- Molecular Formula
- C11H23NO3S
- Molecular Weight
- 249.3760
- Inchikey
- MZXDOHVJCAJUKK-UHFFFAOYSA-N
- Inchi
- InChI=1S/C11H23NO3S/c1-16(14,15)10-8-6-4-2-3-5-7-9-11(12)13/h2-10H2,1H3,(H2,12,13)
- Isomeric Smiles
- CS(=O)(=O)CCCCCCCCCC(=O)N
- Cas Id
- Ob Score
- Mol Logp
- 1.6371
- Num H Donors
- 1
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 10
- Drug Likeness
- 0.5980
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Rorifamide
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Rorifamide
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Rorifamide
Role
preferred
Source
TCMBank
Preferred
Yes
Name
焊材
Role
TCM_name
Source
TCMBank
Preferred
No
Name
HAN CAI
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Indian Rorippa
Role
TCM_name_en
Source
TCMBank
Preferred
No
Name
10-(METHYLSULFONYL)CAPRAMIDE
Role
alias
Source
HERB_v2
Preferred
No
Name
10-(METHYLSULFONYL)CAPRAMIDE
Role
alias
Source
itcmdb_public
Preferred
No
Name
10-(Methanesulfonyl)decanimidic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
10-(Methanesulfonyl)decanimidic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
10-(Methylsulfonyl)decanamide
Role
alias
Source
itcmdb_public
Preferred
No
Name
10-methylsulfonyldecanamide
Role
alias
Source
HERB_v2
Preferred
No
Name
53078-91-4
Role
alias
Source
HERB_v2
Preferred
No
Name
53078-91-4
Role
alias
Source
itcmdb_public
Preferred
No
Name
AKOS027378785
Role
alias
Source
itcmdb_public
Preferred
No
Name
AKOS027378785
Role
alias
Source
HERB_v2
Preferred
No
Name
DECANAMIDE, 10-(METHYLSULFONYL)-
Role
alias
Source
itcmdb_public
Preferred
No
Name
DECANAMIDE, 10-(METHYLSULFONYL)-
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXSID60967589
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXSID60967589
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
焊材HAN CAIIndian Rorippa10-(METHYLSULFONYL)CAPRAMIDE10-(Methanesulfonyl)decanimidic acid10-(Methylsulfonyl)decanamide10-methylsulfonyldecanamide53078-91-4AKOS027378785DECANAMIDE, 10-(METHYLSULFONYL)-DTXSID60967589
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN042406
Npass
NPC266816
Tcmid
18893
Pub Chem
154173
Tcmbank
TCMBANKIN039070
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C11H23NO3S/c1-16(14,15)10-8-6-4-2-3-5-7-9-11(12)13/h2-10H2,1H3,(H2,12,13)
Mol Wt
249.3759999999999
Mol Log P
1.6371
In Ch Ikey
MZXDOHVJCAJUKK-UHFFFAOYSA-N
Tcm Name
焊材
Tcm Name2
HAN CAI
Mol2 Path
/TCM_database/2007_3d_all/18908.mol2
Reference
660
Num Hdonors
1
Tcm Name En
Indian Rorippa
Drug Likeness
0.598
Num Hacceptors
3
Isomeric Smiles
CS(=O)(=O)CCCCCCCCCC(=O)N
Canonical Smiles
CS(=O)(=O)CCCCCCCCCC(=O)N
Herb Alias Names
53078-91-410-methylsulfonyldecanamide10-(Methylsulfonyl)decanamideDECANAMIDE, 10-(METHYLSULFONYL)-10-(METHYLSULFONYL)CAPRAMIDEDTXSID6096758910-(Methanesulfonyl)decanimidic acidAKOS027378785
Molecular Weight
249.37 g/mol
Molecular Formula
C11H23NO3S
Num Rotatable Bonds
10