IngredientID 45163

10'(Z),13'(E),15'(E)-Heptadecatrienylhydroquinone

C23H34O2

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Herb: 1Ingredient: 1Links: 1
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
45163
Core Entity Id
88174
Source Entity Count
1
Preferred Name
10'(Z),13'(E),15'(E)-Heptadecatrienylhydroquinone
Name En
Pubchem Id
11724959
Smiles Canonical
CC=CC=CCC=CCCCCCCCCCC1=C(C=CC(=C1)O)O
Molecular Formula
C23H34O2
Molecular Weight
342.2600
Inchikey
OILIDQCJCUQAGV-YCLNNTPMSA-N
Inchi
InChI=1S/C23H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-20-22(24)18-19-23(21)25/h2-5,7-8,18-20,24-25H,6,9-17H2,1H3/b3-2+,5-4+,8-7-
Isomeric Smiles
Cas Id
Ob Score
Mol Logp
8.2000
Num H Donors
2
Num H Acceptors
2
Num Rotatable Bonds
13
Drug Likeness
Polar Surface Area
40.5000
Molecular Volume
Alogp

Names

Preferred names, aliases, and source labels retained in the final schema.

Name
10'(Z),13'(E),15'(E)-Heptadecatrienylhydroquinone
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
10'(Z),13'(E),15'(E)-Heptadecatrienylhydroquinone
Role
preferred
Source
TCMBank
Preferred
Yes
Name
林背子
Role
TCM_name
Source
TCMBank
Preferred
No
Name
LIN BEI ZI
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Field Lacquertree
Role
TCM_name_en
Source
TCMBank
Preferred
No

Aliases

Additional names normalized into the restored final schema.

林背子LIN BEI ZIField Lacquertree

Cross References

Trusted external identifiers retained for this final record.

Tcmbank
TCMBANKIN017545
Etcm Ingredient
10'(Z),13'(E),15'(E)-Heptadecatrienylhydroquinone
Itcmdb Generated
ITX-INGREDIENT-13E4E4333D00ITX-INGREDIENT-9289800EEE04

Attributes

Merged source attributes and domain-specific metadata.

Tcm Name
林背子
Tcm Name2
LIN BEI ZI
Mol2 Path
/TCM_database/2007_3d_all/09383.mol2
Reference
4662
Tcm Name En
Field Lacquertree
Molecular Weight
342.260
Molecular Formula
C23H34O2
Fda Maximum Daily Dose (Fdamdd)
0.909
Quantitative Estimate Of Drug Likeness(Qed)
0.178