Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 3Ingredient: 1Target: 7Links: 10
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 51252
- Core Entity Id
- 94263
- Source Entity Count
- 1
- Preferred Name
- Garcinone D
- Name En
- Pubchem Id
- 5495926
- Smiles Canonical
- CC(=CCC1=C(C2=C(C=C1O)OC3=C(C2=O)C(=C(C(=C3)O)OC)CCC(C)(C)O)O)C
- Molecular Formula
- C24H28O7
- Molecular Weight
- 428.1800
- Inchikey
- TYALNCRUIKOKGP-UHFFFAOYSA-N
- Inchi
- InChI=1S/C24H28O7/c1-12(2)6-7-13-15(25)10-18-20(21(13)27)22(28)19-14(8-9-24(3,4)29)23(30-5)16(26)11-17(19)31-18/h6,10-11,25-27,29H,7-9H2,1-5H3
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 4.9000
- Num H Donors
- 4
- Num H Acceptors
- 7
- Num Rotatable Bonds
- 6
- Drug Likeness
- Polar Surface Area
- 116.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Garcinone D
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Garcinone D
Role
preferred
Source
TCMBank
Preferred
Yes
Name
藤黄
Role
TCM_name
Source
TCMBank
Preferred
No
Name
TENG HUANG
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Gamboge Tree Resin
Role
TCM_name_en
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
藤黄TENG HUANGGamboge Tree Resin
Cross References
Trusted external identifiers retained for this final record.
Tcmbank
TCMBANKIN037838
Etcm Ingredient
Garcinone D
Itcmdb Generated
ITX-INGREDIENT-CE61C4345109ITX-INGREDIENT-E6B2BC54E849
Attributes
Merged source attributes and domain-specific metadata.
Tcm Name
藤黄
Tcm Name2
TENG HUANG
Mol2 Path
/TCM_database/2007_3d_all/08221.mol2
Reference
1521, 1619, 3066, 4358, 4423, 5319
Tcm Name En
Gamboge Tree Resin
Molecular Weight
428.180
Molecular Formula
C24H28O7
Fda Maximum Daily Dose (Fdamdd)
0.220
Quantitative Estimate Of Drug Likeness（Qed）
0.341