Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 5Links: 6
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 29904
- Core Entity Id
- 36422
- Source Entity Count
- 1
- Preferred Name
- Picrasidine l
- Name En
- Pubchem Id
- 5324104
- Smiles Canonical
- CN1C=CC2=C3C1=CC(=O)C(=O)N3C4=CC=CC=C24
- Molecular Formula
- C15H10N2O2
- Molecular Weight
- 250.2570
- Inchikey
- YIFMSNBQADOPBX-UHFFFAOYSA-N
- Inchi
- InChI=1S/C15H10N2O2/c1-16-7-6-10-9-4-2-3-5-11(9)17-14(10)12(16)8-13(18)15(17)19/h2-8H,1H3
- Isomeric Smiles
- CN1C=CC2=C3C1=CC(=O)C(=O)N3C4=CC=CC=C24
- Cas Id
- Ob Score
- Mol Logp
- 1.6940
- Num H Donors
- 0
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.4460
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Picrasidine L
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Picrasidine l
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Picrasidine l
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
长叶宽木
Role
TCM_name
Source
TCMBank
Preferred
No
Name
CHANG YE KUAN MU
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
96405-70-8
Role
alias
Source
HERB_v2
Preferred
No
Name
96405-70-8
Role
alias
Source
itcmdb_public
Preferred
No
Name
BDBM50067491
Role
alias
Source
itcmdb_public
Preferred
No
Name
BDBM50067491
Role
alias
Source
HERB_v2
Preferred
No
Name
CHEMBL3400663
Role
alias
Source
itcmdb_public
Preferred
No
Name
CHEMBL3400663
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXSID401317660
Role
alias
Source
itcmdb_public
Preferred
No
Name
DTXSID401317660
Role
alias
Source
HERB_v2
Preferred
No
Name
InChI=1/C15H10N2O2/c1-16-7-6-10-9-4-2-3-5-11(9)17-14(10)12(16)8-13(18)15(17)19/h2-8H,1H
Role
alias
Source
HERB_v2
Preferred
No
Name
InChI=1/C15H10N2O2/c1-16-7-6-10-9-4-2-3-5-11(9)17-14(10)12(16)8-13(18)15(17)19/h2-8H,1H
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
长叶宽木CHANG YE KUAN MU96405-70-8BDBM50067491CHEMBL3400663DTXSID401317660InChI=1/C15H10N2O2/c1-16-7-6-10-9-4-2-3-5-11(9)17-14(10)12(16)8-13(18)15(17)19/h2-8H,1H
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN039852
Npass
NPC281094
Tcmid
17290
Pub Chem
5324104
Tcmbank
TCMBANKIN047439
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C15H10N2O2/c1-16-7-6-10-9-4-2-3-5-11(9)17-14(10)12(16)8-13(18)15(17)19/h2-8H,1H3
Mol Wt
250.257
Mol Log P
1.694
In Ch Ikey
YIFMSNBQADOPBX-UHFFFAOYSA-N
Tcm Name
长叶宽木
Tcm Name2
CHANG YE KUAN MU
Mol2 Path
/TCM_database/2007_3d_all/17304.mol2
Reference
4556, 4728
Num Hdonors
0
Drug Likeness
0.446
Num Hacceptors
4
Isomeric Smiles
CN1C=CC2=C3C1=CC(=O)C(=O)N3C4=CC=CC=C24
Canonical Smiles
CN1C=CC2=C3C1=CC(=O)C(=O)N3C4=CC=CC=C24
Herb Alias Names
CHEMBL340066396405-70-8DTXSID401317660BDBM50067491InChI=1/C15H10N2O2/c1-16-7-6-10-9-4-2-3-5-11(9)17-14(10)12(16)8-13(18)15(17)19/h2-8H,1H
Molecular Weight
250.25 g/mol
Molecular Formula
C15H10N2O2
Num Rotatable Bonds
0