Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 3Ingredient: 1Target: 1Links: 4
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 31404
- Core Entity Id
- 38093
- Source Entity Count
- 1
- Preferred Name
- Quercetin-5-o-beta-d-glucoside
- Name En
- Pubchem Id
- 52946987
- Smiles Canonical
- Molecular Formula
- C21H20O12
- Molecular Weight
- 464.4000
- Inchikey
- QJTYCCFDQWFJHU-HMGRVEAOSA-N
- Inchi
- InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)32-12-5-8(23)4-11-14(12)16(27)18(29)20(31-11)7-1-2-9(24)10(25)3-7/h1-5,13,15,17,19,21-26,28-30H,6H2/t13-,15-,17+,19-,21-/m1/s1
- Isomeric Smiles
- Cas Id
- 34199-21-8
- Ob Score
- 4.7810
- Mol Logp
- -0.2000
- Num H Donors
- 8
- Num H Acceptors
- 12
- Num Rotatable Bonds
- 4
- Drug Likeness
- Polar Surface Area
- 207.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Quercetin-5-o-beta-d-glucoside
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Quercetin-5-o-beta-d-glucoside
Role
preferred
Source
itcmdb_public
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Cas
34199-21-8
Herb
HBIN041687
Tcmid
18354
Tcmsp
MOL007188
Sym Map
SMIT00683
Attributes
Merged source attributes and domain-specific metadata.
Cas Id
34199-21-8
Ob Score
4.781
Molecular Formula
C21H20O12