CJ-17,572

AlkaPlorer ID: AK057186

Synonym: None

IUPAC Name: 5-(1-hydroxyethyl)-3-[hydroxy-(1,2,6-trimethyl-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl)methylidene]-1-methylpyrrolidine-2,4-dione

Structure

SMILES: CC1CCC2C(C=CC(C)C2(C)C(O)=C2C(=O)C(C(C)O)N(C)C2=O)C1

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InChI: InChI=1S/C21H31NO4/c1-11-6-9-15-14(10-11)8-7-12(2)21(15,4)19(25)16-18(24)17(13(3)23)22(5)20(16)26/h7-8,11-15,17,23,25H,6,9-10H2,1-5H3

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InChIKey: LVWQDHHIWXPCLH-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Pezicula sp. Pezicula Dermateaceae Helotiales Leotiomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 361.4820000000001

TPSA: 77.84

MolLogP: 2.853600000000001

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information