Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 2350
- Core Entity Id
- 5799
- Source Entity Count
- 1
- Preferred Name
- 2-o-beta-d-glucosyloxy-4-methoxybenzenepropanoic acid
- Name En
- Pubchem Id
- 11100427
- Smiles Canonical
- COC1=CC(=C(C=C1)CCC(=O)O)OC2C(C(C(C(O2)CO)O)O)O
- Molecular Formula
- C16H22O9
- Molecular Weight
- 358.3400
- Inchikey
- LIVNOUBJFOXZOR-YMILTQATSA-N
- Inchi
- InChI=1S/C16H22O9/c1-23-9-4-2-8(3-5-12(18)19)10(6-9)24-16-15(22)14(21)13(20)11(7-17)25-16/h2,4,6,11,13-17,20-22H,3,5,7H2,1H3,(H,18,19)/t11-,13-,14+,15-,16-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -0.8000
- Num H Donors
- 5
- Num H Acceptors
- 9
- Num Rotatable Bonds
- 7
- Drug Likeness
- Polar Surface Area
- 146.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2-O-beta-D-glucosyloxy-4-methoxybenzenepropanoic acid
Role
preferred
Source
TCMBank
Preferred
Yes
Name
2-o-beta-d-glucosyloxy-4-methoxybenzene-propanoicacid
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
2-o-beta-d-glucosyloxy-4-methoxybenzenepropanoic acid
Role
preferred
Source
HERB_v2
Preferred
Yes
Aliases
Additional names normalized into the restored final schema.
2-o-beta-d-glucosyloxy-4-methoxybenzene-propanoicacid
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN006204HBIN006205
Tcmid
354898756
Tcmbank
TCMBANKIN006418
Attributes
Merged source attributes and domain-specific metadata.
Molecular Formula
C16H22O9