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
- 1009
- Core Entity Id
- 4317
- Source Entity Count
- 1
- Preferred Name
- 2,5-dihydroxy-3-[(10z)-pentadec-10-en-1-yl][1,4]benzoquinone
- Name En
- Pubchem Id
- Smiles Canonical
- CCCC/C=C\CCCCCCCCCCCCCCCCCC1=C(O)C(=O)C=C(O)C1=O
- Molecular Formula
- C29H48O4
- Molecular Weight
- 461.0000
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- 34.7390
- Mol Logp
- 10.0000
- Num H Donors
- 2
- Num H Acceptors
- 4
- Num Rotatable Bonds
- 21
- Drug Likeness
- Polar Surface Area
- 75.0000
- Molecular Volume
- 355.0000
- Alogp
- 10.0000
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2,5-Dihydroxy-3-[(10Z)-Pentadec-10-En-1-Yl][1,4]Benzoquinone
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
2,5-Dihydroxy-3-[(10Z)-Pentadec-10-En-1-Yl][1,4]Benzoquinone
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
2,5-dihydroxy-3-[(10Z)-pentadec-10-en-1-yl][1,4]benzoquinone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
2,5-dihydroxy-3-[(10Z)-pentadec-10-en-1-yl][1,4]benzoquinone
Role
preferred
Source
TCMBank
Preferred
Yes
Name
2,5-dihydroxy-3-[(10z)-pentadec-10-en-1-yl][1,4]benzoquinone
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
2,5-dihydroxy-3-[(10z)-pentadec-10-en-1-yl][1,4]benzoquinone
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
矮地茶
Role
TCM_name
Source
TCMBank
Preferred
No
Name
AI DI CHA
Role
TCM_name_en
Source
TCMBank
Preferred
No
Name
9.化痰止咳平喘药(34-34)
Role
level1_name
Source
TCMBank
Preferred
No
Name
cough-suppressing and panting-calming medicinal
Role
level1_name_en
Source
TCMBank
Preferred
No
Name
3.止咳平喘药(11-11)
Role
level2_name
Source
TCMBank
Preferred
No
Name
cough-suppressing and panting-calming medicinal
Role
level2_name_en
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
矮地茶AI DI CHA9.化痰止咳平喘药(34-34)cough-suppressing and panting-calming medicinal3.止咳平喘药(11-11)
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN004615
Tcmsp
MOL010982
Sym Map
SMIT11941
Tcmbank
TCMBANKIN043828
Etcm Ingredient
2,5-dihydroxy-3-[(10Z)-pentadec-10-en-1-yl][1,4]benzoquinone
Itcmdb Generated
ITX-INGREDIENT-2A5828D37B55
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Alog P
10
Smiles
C1(O[H])=C([H])C(=O)C(O[H])=C(C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H]
)([H])C([H])([H])\C([H])=C([H])/C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C1=O
37 Flag
37
C Count
29
N Count
0
O Count
4
P Count
0
S Count
0
Version
v1,v2
Ob Score
34.73934.7392149634.739215
Suppress
0
Tcm Name
矮地茶
Mol2 Path
/TCM_database/9.化痰止咳平喘药(34-34)/3.止咳平喘药(11-11)/矮地茶/Structure/2,5-dihydroxy-3-[(10Z)-pentadec-10-en-1-yl][1,4]benzoquinone.mol2
Tcm Name En
AI DI CHA
Level1 Name
9.化痰止咳平喘药(34-34)
Level2 Name
3.止咳平喘药(11-11)
Num H Donors
2
Level1 Name En
cough-suppressing and panting-calming medicinal
Level2 Name En
cough-suppressing and panting-calming medicinal
Molecule Weight
460.77
Num H Acceptors
4
Molecular Weight
460.360
Molecular Volume
355
Molecular Weight
461
Molecular Formula
C29H48O4
Molecular Formula
C29H48O4
Num Rotatable Bonds
21
Molecular Polar Surface Area
75
Fda Maximum Daily Dose (Fdamdd)
0.037
Quantitative Estimate Of Drug Likeness（Qed）
0.068