Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 12Links: 13
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 63325
- Core Entity Id
- 110343
- Source Entity Count
- 1
- Preferred Name
- Cichoric Acid
- Name En
- Pubchem Id
- 5281764
- Smiles Canonical
- C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)C(=O)O)O)O
- Molecular Formula
- C22H18O12
- Molecular Weight
- 474.0800
- Inchikey
- YDDGKXBLOXEEMN-IABMMNSOSA-N
- Inchi
- InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.0000
- Num H Donors
- 6
- Num H Acceptors
- 12
- Num Rotatable Bonds
- 11
- Drug Likeness
- Polar Surface Area
- 208.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Cichoric Acid
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
cichoric acid
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT22948
Etcm Ingredient
cichoric acid
Itcmdb Generated
ITX-INGREDIENT-ACCAC8D07C0DITX-INGREDIENT-F7A06DB969AB
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Version
v2
Suppress
0
Molecular Weight
474.080
Molecular Formula
C22H18O12
Fda Maximum Daily Dose (Fdamdd)
0.011
Quantitative Estimate Of Drug Likeness（Qed）
0.172