Erinacerin A

AlkaPlorer ID: AK016267

Synonym: '', 'Erinacerin A'

IUPAC Name: (2S)-5-methoxy-2-methyl-2-(4-methyl-2-oxopent-3-enyl)-8-(2-phenylethyl)-4,9-dihydro-3H-pyrano[2,3-e]isoindol-7-one

Structure

SMILES: COC1=CC2=C(CN(CCC3=CC=CC=C3)C2=O)C2=C1CC[C@@](C)(CC(=O)C=C(C)C)O2

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InChI: InChI=1S/C27H31NO4/c1-18(2)14-20(29)16-27(3)12-10-21-24(31-4)15-22-23(25(21)32-27)17-28(26(22)30)13-11-19-8-6-5-7-9-19/h5-9,14-15H,10-13,16-17H2,1-4H3/t27-/m0/s1

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InChIKey: VSETXQQLPHMGQF-MHZLTWQESA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Hericium erinaceus Hericium Hericiaceae Russulales Agaricomycetes Basidiomycota Fungi Eukaryota

Properties Information

Molecule Weight: 433.54800000000034

TPSA: 55.84

MolLogP: 4.9028000000000045

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information