Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 2Ingredient: 1Target: 4Links: 6
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 31581
- Core Entity Id
- 38290
- Source Entity Count
- 1
- Preferred Name
- Raddeanin c
- Name En
- Pubchem Id
- 44445759
- Smiles Canonical
- Molecular Formula
- C24H34O7
- Molecular Weight
- 434.5200
- Inchikey
- ZPDVFDNDMSYUSR-WLMSFTOLSA-N
- Inchi
- InChI=1S/C24H34O7/c1-12-15-7-8-16-22-10-6-9-21(4,5)17(22)20(31-14(3)26)24(28,29-11-22)23(16,18(15)27)19(12)30-13(2)25/h15-20,27-28H,1,6-11H2,2-5H3/t15-,16-,17+,18+,19+,20-,22+,23+,24-/m0/s1
- Isomeric Smiles
- Cas Id
- 128887-82-1
- Ob Score
- 41.7148
- Mol Logp
- 2.1000
- Num H Donors
- 2
- Num H Acceptors
- 7
- Num Rotatable Bonds
- 4
- Drug Likeness
- Polar Surface Area
- 102.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Raddeanin C
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Raddeanin C
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Raddeanin c
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Raddeanin c
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
raddeanin C
Role
preferred
Source
TCMBank
Preferred
Yes
Name
raddeanin c
Role
alias
Source
TCMBank
Preferred
No
Cross References
Trusted external identifiers retained for this final record.
Cas
128887-82-1
Herb
HBIN041894
Tcmid
18502
Tcmsp
MOL000548
Sym Map
SMIT03118
Tcmbank
TCMBANKIN047294
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Cas Id
128887-82-1
Version
v1,v2
Ob Score
41.71478441.7147840841.715
Suppress
0
Mol2 Path
/TCM_database/2007_3d_all/18517.mol2
Reference
660
Molecule Weight
434.58
Molecular Weight
434.52
Molecular Formula
C24H34O7
Molecular Formula
C24H34O7