Phlebiopsin B

Details

• Internal ID: 2b466435-0404-47d7-a4f2-e9134d88966d
• Taxonomy: Benzenoids > Benzene and substituted derivatives
• IUPAC Name: (2R)-2,4-dihydroxy-2,5-diphenylcyclopent-4-ene-1,3-dione
• InChI: InChI=1S/C17H12O4/c18-14-13(11-7-3-1-4-8-11)15(19)17(21,16(14)20)12-9-5-2-6-10-12/h1-10,18,21H/t17-/m1/s1
• InChI Key: DNMVUCBDCPHPAT-QGZVFWFLSA-N
• Popularity: 2 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₇H₁₂O₄
• Molecular Weight: 280.27 g/mol
• Exact Mass: 280.07355886 g/mol
• Topological Polar Surface Area (TPSA): 74.60 Ų
• XlogP: 2.40

Synonyms

There are no found synonyms.

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL221	P23219	Cyclooxygenase-1	96.52%	90.17%
CHEMBL2035	P08912	Muscarinic acetylcholine receptor M5	95.57%	94.62%
CHEMBL2581	P07339	Cathepsin D	95.05%	98.95%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	92.58%	91.11%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	91.77%	95.56%
CHEMBL1821	P08173	Muscarinic acetylcholine receptor M4	89.14%	94.08%
CHEMBL216	P11229	Muscarinic acetylcholine receptor M1	87.70%	94.23%
CHEMBL3091268	Q92753	Nuclear receptor ROR-beta	84.83%	95.50%
CHEMBL1293249	Q13887	Kruppel-like factor 5	82.68%	86.33%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 146684139
• LOTUS: LTS0075502
• wikiData: Q104985641