IngredientID 25976

Methyl 15-hydroperoxy-8alpha,14alpha,12alpha,13alpha-diepoxiabietan-13-en-19-oate

C21H32O6

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Relationship Network

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Herb: 2Ingredient: 1Links: 2
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
25976
Core Entity Id
32066
Source Entity Count
1
Preferred Name
Methyl 15-hydroperoxy-8alpha,14alpha,12alpha,13alpha-diepoxiabietan-13-en-19-oate
Name En
Pubchem Id
Smiles Canonical
Molecular Formula
C21H32O6
Molecular Weight
380.2200
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
Methyl 15-hydroperoxy-8-alpha,14-alpha,12-alpha,13-alpha-diepoxiabietan-13-en-19-oate
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Methyl 15-hydroperoxy-8alpha,14alpha,12alpha,13alpha-diepoxiabietan-13-en-19-oate
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Methyl 15-hydroperoxy-8alpha,14alpha,12alpha,13alpha-diepoxiabietan-13-en-19-oate
Role
preferred
Source
itcmdb_public
Preferred
Yes

Aliases

Additional names normalized into the restored final schema.

Methyl 15-hydroperoxy-8-alpha,14-alpha,12-alpha,13-alpha-diepoxiabietan-13-en-19-oate

Cross References

Trusted external identifiers retained for this final record.

Herb
HBIN034886
Tcmid
14487
Etcm Ingredient
Methyl 15-hydroperoxy-8-alpha,14-alpha,12-alpha,13-alpha-diepoxiabietan-13-en-19-oate
Itcmdb Generated
ITX-INGREDIENT-1C248C8FD18D

Attributes

Merged source attributes and domain-specific metadata.

Molecular Weight
380.220
Molecular Formula
C21H32O6
Molecular Formula
C21H32O6
Fda Maximum Daily Dose (Fdamdd)
0.447
Quantitative Estimate Of Drug Likeness(Qed)
0.350