Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 1Links: 3
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 22675
- Core Entity Id
- 28389
- Source Entity Count
- 1
- Preferred Name
- Isoincensolol
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C20H36O4
- Molecular Weight
- 340.5600
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- 15.0910
- Mol Logp
- 3.0000
- Num H Donors
- 3
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 1
- Drug Likeness
- Polar Surface Area
- 70.0000
- Molecular Volume
- 265.0000
- Alogp
- 3.0000
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Isoincensolol
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Isoincensolol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Isoincensolol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Isoincensolol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
isoincensolol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
isoincensolol
Role
preferred
Source
TCMBank
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN030822
Tcmsp
MOL001280
Sym Map
SMIT03727
Tcmbank
TCMBANKIN040027
Etcm Ingredient
isoincensolol
Itcmdb Generated
ITX-INGREDIENT-75130EEB95F1
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Alog P
3
37 Flag
37
C Count
20
N Count
0
O Count
4
P Count
0
S Count
0
Version
v1,v2
Ob Score
15.09115.09141615.09141632
Suppress
0
Mol2 Path
/TCM_database/8.活血化瘀药(33-33)/1.活血止痛药(7-7)/乳香/Structures/isoincensolol.mol2
Num H Donors
3
Molecule Weight
340.56
Num H Acceptors
4
Molecular Weight
340.260
Molecular Volume
265
Molecular Weight
340.56
Molecular Formula
C20H36O4
Num Rotatable Bonds
1
Molecular Polar Surface Area
70
Fda Maximum Daily Dose (Fdamdd)
0.891
Quantitative Estimate Of Drug Likeness（Qed）
0.640