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
- 59306
- Core Entity Id
- 102317
- Source Entity Count
- 1
- Preferred Name
- Curcolnol
- Name En
- Pubchem Id
- 45359845
- Smiles Canonical
- Cc1coc2c1C(=O)C1C(C)(O)CCC(O)C1(C)C2
- Molecular Formula
- C15H20O4
- Molecular Weight
- 264.3200
- Inchikey
- QXEXMTIZXNCRJO-UHFFFAOYSA-N
- Inchi
- InChI=1S/C15H20O4/c1-8-7-19-9-6-14(2)10(16)4-5-15(3,18)13(14)12(17)11(8)9/h7,10,13,16,18H,4-6H2,1-3H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 1.3000
- Num H Donors
- 2
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 0
- Drug Likeness
- Polar Surface Area
- 70.7000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Curcolnol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
curcolnol
Role
preferred
Source
TCMBank
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN021932
Sym Map
SMIT23193
Tcmbank
TCMBANKIN060052
Itcmdb Generated
ITX-INGREDIENT-CE7C37A6847F
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Smiles
CC1=COC2=C1C(=O)C3C(CCC(C3(C2)C)O)(C)O
Version
v2
Suppress
0
Molecular Formula
C15H20O4