IngredientID 13307

C17-obtusilactone dimer

C34H52O6

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Relationship Network

Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.

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Herb: 1Ingredient: 1Links: 1
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
13307
Core Entity Id
17959
Source Entity Count
1
Preferred Name
C17-obtusilactone dimer
Name En
Pubchem Id
Smiles Canonical
Molecular Formula
C34H52O6
Molecular Weight
556.3800
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
C17-Obtusilactone dimer
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
C17-obtusilactone dimer
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
C17-obtusilactone dimer
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
c17-obtusilactone dimer
Role
preferred
Source
TCMBank
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Herb
HBIN019214
Tcmid
2836
Tcmbank
TCMBANKIN037546
Etcm Ingredient
C17-Obtusilactone dimer
Itcmdb Generated
ITX-INGREDIENT-F1B3674851BF

Attributes

Merged source attributes and domain-specific metadata.

Mol2 Path
/TCM_database/2007_3d_all/02836.mol2
Reference
2881
Molecular Weight
556.380
Molecular Formula
C34H52O6
Molecular Formula
C34H52O6
Molecular Formula
C34H52O6
Fda Maximum Daily Dose (Fdamdd)
0.022
Quantitative Estimate Of Drug Likeness(Qed)
0.037