Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 4Ingredient: 1Links: 4
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 36006
- Core Entity Id
- 43211
- Source Entity Count
- 1
- Preferred Name
- Turanose
- Name En
- Pubchem Id
- 5460935
- Smiles Canonical
- C(C1C(C(C(C(O1)OC(C(C(CO)O)O)C(=O)CO)O)O)O)O
- Molecular Formula
- C12H22O11
- Molecular Weight
- 342.2970
- Inchikey
- RULSWEULPANCDV-PIXUTMIVSA-N
- Inchi
- InChI=1S/C12H22O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4,6-16,18-21H,1-3H2/t4-,6-,7-,8-,9+,10-,11-,12-/m1/s1
- Isomeric Smiles
- C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]([C@@H]([C@@H](CO)O)O)C(=O)CO)O)O)O)O
- Cas Id
- Ob Score
- Mol Logp
- -5.5530
- Num H Donors
- 8
- Num H Acceptors
- 11
- Num Rotatable Bonds
- 8
- Drug Likeness
- 0.2090
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Turanose
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Turanose
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Turanose
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Turanose
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
turanose
Role
preferred
Source
TCMBank
Preferred
Yes
Name
(3S,4R,5R)-1,4,5,6-Tetrahydroxy-3-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)hexan-2-one
Role
alias
Source
HERB_v2
Preferred
No
Name
(3S,4R,5R)-1,4,5,6-Tetrahydroxy-3-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)hexan-2-one
Role
alias
Source
itcmdb_public
Preferred
No
Name
3-O-a-D-glucopyranosyl-D-Fructose
Role
alias
Source
itcmdb_public
Preferred
No
Name
3-O-a-D-glucopyranosyl-D-Fructose
Role
alias
Source
HERB_v2
Preferred
No
Name
6D600ARY3R
Role
alias
Source
HERB_v2
Preferred
No
Name
6D600ARY3R
Role
alias
Source
itcmdb_public
Preferred
No
Name
D-(+)-Turanose (VAN)
Role
alias
Source
itcmdb_public
Preferred
No
Name
D-(+)-Turanose (VAN)
Role
alias
Source
HERB_v2
Preferred
No
Name
D-Fructose, 3-O-.alpha.-D-glucopyranosyl-
Role
alias
Source
itcmdb_public
Preferred
No
Name
D-Fructose, 3-O-.alpha.-D-glucopyranosyl-
Role
alias
Source
HERB_v2
Preferred
No
Name
NSC-1222
Role
alias
Source
HERB_v2
Preferred
No
Name
NSC-1222
Role
alias
Source
itcmdb_public
Preferred
No
Name
TURANOSE [MI]
Role
alias
Source
HERB_v2
Preferred
No
Name
TURANOSE [MI]
Role
alias
Source
itcmdb_public
Preferred
No
Name
Turanose (van)
Role
alias
Source
HERB_v2
Preferred
No
Name
Turanose (van)
Role
alias
Source
itcmdb_public
Preferred
No
Name
beta-turanose
Role
alias
Source
HERB_v2
Preferred
No
Name
beta-turanose
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
(3S,4R,5R)-1,4,5,6-Tetrahydroxy-3-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)hexan-2-one3-O-a-D-glucopyranosyl-D-Fructose6D600ARY3RD-(+)-Turanose (VAN)D-Fructose, 3-O-.alpha.-D-glucopyranosyl-NSC-1222TURANOSE [MI]Turanose (van)beta-turanose
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN047365
Npass
NPC273594
Tcmid
22102
Sym Map
SMIT18110
Pub Chem
5460935
Tcmbank
TCMBANKIN012532
Etcm Ingredient
Turanose
Itcmdb Generated
ITX-INGREDIENT-1E4D1B626CD6
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C12H22O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4,6-16,18-21H,1-3H2/t4-,6-,7-,8-,9+,10-,11-,12-/m1/s1
Mol Wt
342.297
Smiles
C(C1C(C(C(C(O1)OC(C(C(CO)O)O)C(=O)CO)O)O)O)O
Mol Log P
-5.552999999999995
Version
v1,v2
In Ch Ikey
RULSWEULPANCDV-PIXUTMIVSA-N
Suppress
0
Num Hdonors
8
Drug Likeness
0.209
Num Hacceptors
11
Isomeric Smiles
C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]([C@@H]([C@@H](CO)O)O)C(=O)CO)O)O)O)O
Canonical Smiles
C(C1C(C(C(C(O1)OC(C(C(CO)O)O)C(=O)CO)O)O)O)O
Herb Alias Names
Turanose (van)D-(+)-Turanose (VAN)6D600ARY3R(3S,4R,5R)-1,4,5,6-Tetrahydroxy-3-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)hexan-2-oneD-Fructose, 3-O-.alpha.-D-glucopyranosyl-beta-turanoseNSC-12223-O-a-D-glucopyranosyl-D-FructoseTURANOSE [MI]
Molecular Weight
342.120
Molecular Weight
342.3 g/mol
Molecular Formula
C12H22O11
Molecular Formula
C12H22O11
Molecular Formula
C12H22O11
Num Rotatable Bonds
8
Fda Maximum Daily Dose (Fdamdd)
0.000
Quantitative Estimate Of Drug Likeness（Qed）
0.238