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: 2
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 6939
- Core Entity Id
- 10893
- Source Entity Count
- 1
- Preferred Name
- 5-hydroxy-1-methoxyxanthone
- Name En
- Pubchem Id
- 479656
- Smiles Canonical
- COC1=CC=CC2=C1C(=O)C3=C(O2)C(=CC=C3)O
- Molecular Formula
- C14H10O4
- Molecular Weight
- 242.2300
- Inchikey
- GCAMSSLNXVYMKS-UHFFFAOYSA-N
- Inchi
- InChI=1S/C14H10O4/c1-17-10-6-3-7-11-12(10)13(16)8-4-2-5-9(15)14(8)18-11/h2-7,15H,1H3
- Isomeric Smiles
- COC1=CC=CC2=C1C(=O)C3=C(O2)C(=CC=C3)O
- Cas Id
- Ob Score
- Mol Logp
- 2.6604
- Num H Donors
- 1
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 1
- Drug Likeness
- 0.6660
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
5-Hydroxy-1-methoxyxanthone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
5-Hydroxy-1-methoxyxanthone
Role
preferred
Source
TCMBank
Preferred
Yes
Name
5-hydroxy-1-methoxyxanthone
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
5-hydroxy-1-methoxyxanthone
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
台湾绿岛藤黄
Role
TCM_name
Source
TCMBank
Preferred
No
Name
TAI WAN LV DAO TENG HUANG
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Lanyu Garcinia
Role
TCM_name_en
Source
TCMBank
Preferred
No
Name
27770-13-4
Role
alias
Source
HERB_v2
Preferred
No
Name
27770-13-4
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-Hydroxy-1-methoxy-9H-xanthen-9-one
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-Hydroxy-1-methoxy-9H-xanthen-9-one
Role
alias
Source
HERB_v2
Preferred
No
Name
5-Hydroxy-1-methoxyxanthen-9-one
Role
alias
Source
itcmdb_public
Preferred
No
Name
5-hydroxy-1-methoxyxanthen-9-one
Role
alias
Source
HERB_v2
Preferred
No
Name
9H-Xanthen-9-one, 5-hydroxy-1-methoxy-
Role
alias
Source
itcmdb_public
Preferred
No
Name
9H-Xanthen-9-one, 5-hydroxy-1-methoxy-
Role
alias
Source
HERB_v2
Preferred
No
Name
BDBM50155433
Role
alias
Source
HERB_v2
Preferred
No
Name
BDBM50155433
Role
alias
Source
itcmdb_public
Preferred
No
Name
CHEMBL187159
Role
alias
Source
HERB_v2
Preferred
No
Name
CHEMBL187159
Role
alias
Source
itcmdb_public
Preferred
No
Name
DTXSID20333064
Role
alias
Source
HERB_v2
Preferred
No
Name
DTXSID20333064
Role
alias
Source
itcmdb_public
Preferred
No
Name
Xanthen-9-one, 5-hydroxy-1-methoxy-
Role
alias
Source
HERB_v2
Preferred
No
Name
Xanthen-9-one, 5-hydroxy-1-methoxy-
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
台湾绿岛藤黄TAI WAN LV DAO TENG HUANGLanyu Garcinia27770-13-45-Hydroxy-1-methoxy-9H-xanthen-9-one5-Hydroxy-1-methoxyxanthen-9-one9H-Xanthen-9-one, 5-hydroxy-1-methoxy-BDBM50155433CHEMBL187159DTXSID20333064Xanthen-9-one, 5-hydroxy-1-methoxy-
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN011573
Npass
NPC209278
Tcmid
10461
Pub Chem
479656
Tcmbank
TCMBANKIN037626
Etcm Ingredient
5-Hydroxy-1-methoxyxanthone
Itcmdb Generated
ITX-INGREDIENT-B874E81898D5
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C14H10O4/c1-17-10-6-3-7-11-12(10)13(16)8-4-2-5-9(15)14(8)18-11/h2-7,15H,1H3
Mol Wt
242.23
Mol Log P
2.660400000000001
In Ch Ikey
GCAMSSLNXVYMKS-UHFFFAOYSA-N
Tcm Name
台湾绿岛藤黄
Tcm Name2
TAI WAN LV DAO TENG HUANG
Mol2 Path
/TCM_database/2007_3d_all/10462.mol2
Reference
4094
Num Hdonors
1
Tcm Name En
Lanyu Garcinia
Drug Likeness
0.666
Num Hacceptors
4
Isomeric Smiles
COC1=CC=CC2=C1C(=O)C3=C(O2)C(=CC=C3)O
Canonical Smiles
COC1=CC=CC2=C1C(=O)C3=C(O2)C(=CC=C3)O
Herb Alias Names
27770-13-45-hydroxy-1-methoxyxanthen-9-one9H-Xanthen-9-one, 5-hydroxy-1-methoxy-CHEMBL187159Xanthen-9-one, 5-hydroxy-1-methoxy-5-Hydroxy-1-methoxy-9H-xanthen-9-one5-Hydroxy-1-methoxyxanthen-9-oneDTXSID203330645-Hydroxy-1-methoxy-xanthen-9-oneBDBM50155433
Molecular Weight
242.060
Molecular Weight
242.23 g/mol
Molecular Formula
C14H10O4
Molecular Formula
C14H10O4
Num Rotatable Bonds
1
Fda Maximum Daily Dose (Fdamdd)
0.057
Quantitative Estimate Of Drug Likeness（Qed）
0.666