Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 2Ingredient: 1Target: 12Links: 14
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 31370
- Core Entity Id
- 38055
- Source Entity Count
- 1
- Preferred Name
- Quercetin-3-o-beta-d-galactoside
- Name En
- Pubchem Id
- 5281643
- Smiles Canonical
- C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
- Molecular Formula
- C21H20O12
- Molecular Weight
- 464.4000
- Inchikey
- OVSQVDMCBVZWGM-DTGCRPNFSA-N
- Inchi
- InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- 1.8580
- Mol Logp
- 0.4000
- 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-3-o-beta-d-galactoside
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Quercetin-3-o-beta-d-galactoside
Role
preferred
Source
itcmdb_public
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN041626
Tcmid
36083
Tcmsp
MOL000999
Sym Map
SMIT03483
Attributes
Merged source attributes and domain-specific metadata.
Ob Score
1.858