Agonodepside B structure

Agonodepside B

6-[(E)-but-2-en-2-yl]-4-[6-[(E)-but-2-en-2-yl]-2,4-dihydroxy-3-methylbenzoyl]oxy-2-hydroxy-3-methylbenzoic acid

Also Known As: Agonodepside B|HY-N10242|J1.781.985B|6-[(E)-but-2-en-2-yl]-4-[6-[(E)-but-2-en-2-yl]-2,4-dihydroxy-3-methylbenzoyl]oxy-2-hydroxy-3-methylbenzoic acid|2,4-dihydroxy-3-methyl-6-[(1E)-1-methyl-1-propen-1-yl]-benzoic acid, 4-carboxy-3-hydroxy-2-methyl-5-[(1E)-1-methyl-1-propen-1-yl]phenyl ester|benzoic acid, 4-[[2,4-dihydroxy-3-methyl-6-[(1E)-1-methyl-1-propenyl]benzoyl]oxy]-2-hydroxy-3-methyl-6-[(1E)-1-methyl-1-propenyl]-|2-Hydroxy-4-[2,4-dihydroxy-3-methyl-6-[(E)-1-methyl-1-propenyl]benzoyloxy]-3-methyl-6-[(E)-1-methyl-1-propenyl]benzoic acid|4-({2,4-dihydroxy-3-methyl-6-[(1E)-1-methylprop-1-en-1-yl]benzoyl}oxy)-2-hydroxy-3-methyl-6-[(1E)-1-methylprop-1-en-1-yl]benzoic acid|4-[2,4-dihydroxy-3-methyl-6-[(E)-1-methylprop-1-enyl]benzoyl]oxy-2-hydroxy-3-methyl-6-[(E)-1-methylprop-1-enyl]benzoic acid|6-((E)-But-2-en-2-yl)-4-((6-((E)-but-2-en-2-yl)-2,4-dihydroxy-3-methylbenzoyl)oxy)-2-hydroxy-3-methylbenzoic acid|6-((E)-but-2-en-2-yl)-4-(6-((E)-but-2-en-2-yl)-2,4-dihydroxy-3-methylbenzoyl)oxy-2-hydroxy-3-methylbenzoic acid|6-[(2E)-but-2-en-2-yl]-4-{6-[(2E)-but-2-en-2-yl]-2,4-dihydroxy-3-methylbenzoyloxy}-2-hydroxy-3-methylbenzoic acid|N/A

CAS: 445298-41-9
Molecular Formula C24H26O7
Molecular Weight 426.16785 g/mol
LogP 6.9
Topological Polar Surface Area 124.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 426.16785
Monoisotopic Mass 426.16785
Heavy Atoms 31
Complexity 727.0

Chemical Identifiers

CAS Number 445298-41-9
SMILES C/C=C(\C)/C1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C(=C2)/C(=C/C)/C)C(=O)O)O)C)O)C)O
InChIKey LFTHRDXERPBJOF-MKICQXMISA-N

Product Overview

Agonodepside B (CAS 445298-41-9), with molecular formula C24H26O7 and molecular weight 426.16785 g/mol. IUPAC: 6-[(E)-but-2-en-2-yl]-4-[6-[(E)-but-2-en-2-yl]-2,4-dihydroxy-3-methylbenzoyl]oxy-2-hydroxy-3-methylbenzoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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