IngredientID 43945

8-Oxo-6,7,9,10-tetrahydrohumulen-1,12-olide

C15H22O3

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Ingredient: 1Target: 1Links: 2
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
43945
Core Entity Id
86956
Source Entity Count
1
Preferred Name
8-Oxo-6,7,9,10-tetrahydrohumulen-1,12-olide
Name En
Pubchem Id
Smiles Canonical
Molecular Formula
C15H22O3
Molecular Weight
250.1600
Inchikey
Inchi
Isomeric Smiles
Cas Id
Ob Score
Mol Logp
Num H Donors
Num H Acceptors
Num Rotatable Bonds
Drug Likeness
Polar Surface Area
Molecular Volume
Alogp

Names

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

Name
8-Oxo-6,7,9,10-tetrahydrohumulen-1,12-olide
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
8-Oxo-6,7,9,10-tetrahydrohumulen-1,12-olide
Role
preferred
Source
TCMBank
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Tcmbank
TCMBANKIN013285
Etcm Ingredient
8-Oxo-6,7,9,10-tetrahydrohumulen-1,12-olide
Itcmdb Generated
ITX-INGREDIENT-EC694B28AA64ITX-INGREDIENT-F75F966F7771

Attributes

Merged source attributes and domain-specific metadata.

Tcm Name
Tcm Name2
Asteriscus vogelii
Mol2 Path
/TCM_database/2007_3d_all/16427.mol2
Reference
5123
Molecular Weight
250.160
Molecular Formula
C15H22O3
Fda Maximum Daily Dose (Fdamdd)
0.136
Quantitative Estimate Of Drug Likeness(Qed)
0.765