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
- 63490
- Core Entity Id
- 110508
- Source Entity Count
- 1
- Preferred Name
- Dehydroabietinol
- Name En
- Pubchem Id
- 15586718
- Smiles Canonical
- CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CO)C
- Molecular Formula
- C20H30O
- Molecular Weight
- 286.5000
- Inchikey
- WSKGRAGZAQRSED-SLFFLAALSA-N
- Inchi
- InChI=1S/C20H30O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18,21H,5,7,9-11,13H2,1-4H3/t18-,19-,20+/m0/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 5.7000
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 20.2000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Dehydroabietinol
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Dehydroabietinol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT23377
Pub Chem
15586718
Itcmdb Generated
ITX-INGREDIENT-A684C3BA772F
Attributes
Merged source attributes and domain-specific metadata.
Type
Blood ingredients
Version
v2
Suppress
0
Molecule Formula
C20H30O