Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 5Ingredient: 1Target: 12Links: 17
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 20328
- Core Entity Id
- 25775
- Source Entity Count
- 1
- Preferred Name
- Glb
- Name En
- Pubchem Id
- 439353
- Smiles Canonical
- C(C1C(C(C(C(O1)O)O)O)O)O
- Molecular Formula
- C6H12O6
- Molecular Weight
- 180.1560
- Inchikey
- WQZGKKKJIJFFOK-FPRJBGLDSA-N
- Inchi
- InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6-/m1/s1
- Isomeric Smiles
- C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O
- Cas Id
- 7296-64-2
- Ob Score
- 47.7110
- Mol Logp
- -3.2214
- Num H Donors
- 5
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 1
- Drug Likeness
- 0.2900
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Glb
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Glb
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Glb
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Glb
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
.beta.-D-Galactopyranose
Role
alias
Source
itcmdb_public
Preferred
No
Name
7296-64-2
Role
alias
Source
itcmdb_public
Preferred
No
Name
7296-64-2
Role
alias
Source
HERB_v2
Preferred
No
Name
CHEBI:27667
Role
alias
Source
itcmdb_public
Preferred
No
Name
CHEBI:27667
Role
alias
Source
HERB_v2
Preferred
No
Name
Gal-beta
Role
alias
Source
HERB_v2
Preferred
No
Name
Gal-beta
Role
alias
Source
itcmdb_public
Preferred
No
Name
Galactitol,1,5-anhydro-1-C-phenyl-
Role
alias
Source
HERB_v2
Preferred
No
Name
Galactitol,1,5-anhydro-1-C-phenyl-
Role
alias
Source
itcmdb_public
Preferred
No
Name
Sarcotoxin iib
Role
alias
Source
HERB_v2
Preferred
No
Name
Sarcotoxin iib
Role
alias
Source
itcmdb_public
Preferred
No
Name
beta-D-Gal
Role
alias
Source
HERB_v2
Preferred
No
Name
beta-D-Gal
Role
alias
Source
itcmdb_public
Preferred
No
Name
beta-D-galactopyranose
Role
alias
Source
HERB_v2
Preferred
No
Name
beta-D-galactose
Role
alias
Source
HERB_v2
Preferred
No
Name
beta-D-galactose
Role
alias
Source
itcmdb_public
Preferred
No
Name
beta-Galactose
Role
alias
Source
HERB_v2
Preferred
No
Name
beta-Galactose
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
.beta.-D-Galactopyranose7296-64-2CHEBI:27667Gal-betaGalactitol,1,5-anhydro-1-C-phenyl-Sarcotoxin iibbeta-D-Galbeta-D-galactopyranosebeta-D-galactosebeta-Galactose
Cross References
Trusted external identifiers retained for this final record.
Cas
7296-64-2
Herb
HBIN027927
Npass
NPC255377
Tcmsp
MOL004668
Sym Map
SMIT06549
Pub Chem
439353
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6-/m1/s1
Mol Wt
180.156
Cas Id
7296-64-2
Mol Log P
-3.221399999999999
Version
v1,v2
In Ch Ikey
WQZGKKKJIJFFOK-FPRJBGLDSA-N
Ob Score
47.71147.71116267
Suppress
0
Num Hdonors
5
Drug Likeness
0.29
Num Hacceptors
6
Isomeric Smiles
C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O
Molecule Weight
180.18
Canonical Smiles
C(C1C(C(C(C(O1)O)O)O)O)O
Herb Alias Names
beta-D-galactosebeta-D-galactopyranose7296-64-2beta-Galactosebeta-D-GalGal-beta.beta.-D-GalactopyranoseGalactitol,1,5-anhydro-1-C-phenyl-Sarcotoxin iibCHEBI:27667
Molecular Formula
C6H12O6
Num Rotatable Bonds
1