Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 12Ingredient: 1Links: 12
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 71039
- Core Entity Id
- 133688
- Source Entity Count
- 1
- Preferred Name
- Cocositol
- Name En
- Pubchem Id
- 892
- Smiles Canonical
- C1(C(C(C(C(C1O)O)O)O)O)O
- Molecular Formula
- C6H12O6
- Molecular Weight
- 180.0600
- Inchikey
- CDAISMWEOUEBRE-UHFFFAOYSA-N
- Inchi
- InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -3.7000
- Num H Donors
- 6
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 0
- Drug Likeness
- Polar Surface Area
- 121.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Cocositol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
Cocositol
Itcmdb Generated
ITX-INGREDIENT-D9968954EB7F
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
180.060
Molecular Formula
C6H12O6
Fda Maximum Daily Dose (Fdamdd)
0.002
Quantitative Estimate Of Drug Likeness（Qed）
0.227