Same Parent, Connectivity for PubChem Compound (Select 13855800) - PubChem Compound - NCBI

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Items: 2

Select item 138558001.

an image of a chemical structure CID 13855800

111420-61-2; (3aS,5aS,9bR)-5a,9-dimethyl-3-methylidene-3a,4,6,7,8,9b-hexahydrobenzo[g][1]benzofuran-2,5-dione; 9-Oxotournefortiolide, Tourneforin ...

MW:: 246.300
MF:: C₁₅H₁₈O₃

IUPAC name:: (3aS,5aS,9bR)-5a,9-dimethyl-3-methylidene-3a,4,6,7,8,9b-hexa...

Create Date:: 2007-02-08

CID:: 13855800

Summary Same Parent, Connectivity

Select item 138557992.

an image of a chemical structure CID 13855799

CHEBI:181113; 5a,9-Dimethyl-3-methylidene-3a,4,6,7,8,9b-hexahydrobenzo[g][1]benzofuran-2,5-dione; 5a,9-dimethyl-3-methylidene-3a,4,6,7,8,9b-hexahydrobenzo[g][1]benzouran-2,5-dione

MW:: 246.300
MF:: C₁₅H₁₈O₃

IUPAC name:: 5a,9-dimethyl-3-methylidene-3a,4,6,7,8,9b-hexahydrobenzo[g][...

Create Date:: 2007-02-08

CID:: 13855799

Summary Same Parent, Connectivity

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Chemical Properties

Rule of 5 (2)
Compounds satisfied Lipinski's Rule of Five in evaluating druglikeness. Query: (-5:5[LOGP]) AND (0:500[MOLWT]) AND (0:5[HBDC]) AND (0:10[HBAC]).

BioActivity Experiments

BioAssays, Active (1)
Compounds identified as active in screening experiments

BioAssays, Tested (1)
Compounds identified as tested in screening experiments

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Same Parent, Connectivity for PubChem Compound (Select 13855800) (2)
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Profile neighbors for GEO Profiles (Select 114917857) (200)
GEO Profiles
Protein (RefSeq) for Protein (Select 317373537) (4)
Protein
isocitrate dehydrogenase [NAD] subunit gamma, mitochondrial isoform a precursor ...
isocitrate dehydrogenase [NAD] subunit gamma, mitochondrial isoform a precursor [Homo sapiens]
gi|4758582|ref|NP_004126.1|

Protein

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