Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 1Links: 2
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 41621
- Core Entity Id
- 84632
- Source Entity Count
- 1
- Preferred Name
- Α- Glucosidase Inhibitor
- Name En
- Pubchem Id
- 5087647
- Smiles Canonical
- Cc1cc(=O)c2c(O)c(C3OC(CO)C(O)C(O)C3O)c(O)cc2o1
- Molecular Formula
- C16H18O9
- Molecular Weight
- 354.3100
- Inchikey
- XTZWWMZDVUKEDJ-UHFFFAOYSA-N
- Inchi
- InChI=1S/C16H18O9/c1-5-2-6(18)10-8(24-5)3-7(19)11(13(10)21)16-15(23)14(22)12(20)9(4-17)25-16/h2-3,9,12,14-17,19-23H,4H2,1H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -0.7000
- Num H Donors
- 6
- Num H Acceptors
- 9
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 157.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Α- Glucosidase Inhibitor
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
α- glucosidase inhibitor
Role
preferred
Source
TCMBank
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT27561
Tcmbank
TCMBANKIN005128
Itcmdb Generated
ITX-INGREDIENT-AB88819696BF
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Smiles
CC1=CC(=O)C2=C(C(=C(C=C2O1)O)C3C(C(C(C(O3)CO)O)O)O)O
Version
v2
Suppress
0
Molecular Formula
C16H18O9