Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 2Links: 3
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 71372
- Core Entity Id
- 134021
- Source Entity Count
- 1
- Preferred Name
- Decussatin
- Name En
- Pubchem Id
- 5378284
- Smiles Canonical
- COC1=C(C2=C(C=C1)OC3=CC(=CC(=C3C2=O)O)OC)OC
- Molecular Formula
- C16H14O6
- Molecular Weight
- 302.0800
- Inchikey
- VYRIGRQQKUZPEX-UHFFFAOYSA-N
- Inchi
- InChI=1S/C16H14O6/c1-19-8-6-9(17)13-12(7-8)22-10-4-5-11(20-2)16(21-3)14(10)15(13)18/h4-7,17H,1-3H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 3.1000
- Num H Donors
- 1
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 3
- Drug Likeness
- Polar Surface Area
- 74.2000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Decussatin
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
Decussatin
Itcmdb Generated
ITX-INGREDIENT-DB807F82EF5A
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
302.080
Molecular Formula
C16H14O6
Fda Maximum Daily Dose (Fdamdd)
0.146
Quantitative Estimate Of Drug Likeness（Qed）
0.749