Schelhammeridine; 8-Oxo

AlkaPlorer ID: AK191946

Synonym: 8-Oxoschelhammeridine, Alkaloid K

IUPAC Name: 20-methoxy-5,7-dioxa-14-azapentacyclo[12.7.0.01,17.02,10.04,8]henicosa-2,4(8),9,16,18-pentaen-15-one

Structure

SMILES: COC1C=CC2=CC(=O)N3CCCC4=CC5=C(C=C4C23C1)OCO5

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InChI: InChI=1S/C19H19NO4/c1-22-14-5-4-13-8-18(21)20-6-2-3-12-7-16-17(24-11-23-16)9-15(12)19(13,20)10-14/h4-5,7-9,14H,2-3,6,10-11H2,1H3

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InChIKey: LSHGROWWKJBPBW-UHFFFAOYSA-N

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Reference

PubChem CID: 14589889

COCONUT: CNP0260737

Source

Species Genus Family Order Class Phylum Kingdom Domain
None Schelhammera Colchicaceae Liliales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 325.3640000000001

TPSA: 48.0

MolLogP: 2.3003

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information