8-Chlororugulovasine A

AlkaPlorer ID: AK002306

Synonym: '', '8-Chlororugulovasine B'

IUPAC Name: (4R,5S)-8-chloro-3'-methyl-4-(methylamino)spiro[3,4-dihydro-1H-benzo[cd]indole-5,5'-furan]-2'-one

Structure

SMILES: CN[C@@H]1CC2=CNC3=C(Cl)C=CC(=C23)[C@@]12C=C(C)C(=O)O2

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InChI: InChI=1S/C16H15ClN2O2/c1-8-6-16(21-15(8)20)10-3-4-11(17)14-13(10)9(7-19-14)5-12(16)18-2/h3-4,6-7,12,18-19H,5H2,1-2H3/t12-,16+/m1/s1

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InChIKey: SDYOUVJWVNBXPX-WBMJQRKESA-N

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Reference

Penicillium Toxins

PubChem CID: 16057824

LOTUS: LTS0021498

Source

Species Genus Family Order Class Phylum Kingdom Domain
Talaromyces islandicus Talaromyces Trichocomaceae Eurotiales Eurotiomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 302.761

TPSA: 54.120000000000005

MolLogP: 2.663800000000001

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information