pentyl (1S,5R,6R,7R)-3-(naphthalen-1-yl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.0¹,⁵]dec-8-ene-6-carboxylate

AlkaPlorer ID: AK455658

Synonym: None

IUPAC Name: pentyl (1S,5R,6R,7R)-3-naphthalen-1-yl-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-6-carboxylate

Structure

SMILES: CCCCCOC(=O)[C@@H]1[C@H]2C(=O)N(C3=CC=CC4=CC=CC=C34)C[C@]23C=C[C@H]1O3

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InChI: InChI=1S/C24H25NO4/c1-2-3-6-14-28-23(27)20-19-12-13-24(29-19)15-25(22(26)21(20)24)18-11-7-9-16-8-4-5-10-17(16)18/h4-5,7-13,19-21H,2-3,6,14-15H2,1H3/t19-,20+,21+,24-/m1/s1

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InChIKey: MIJGALVNUOMISF-MDAIXWLXSA-N

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Reference

Coumarins from Eriostemon spicatus

PubChem CID: 1798334

SuperNatural Ⅲ: SN0226490-05

Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 391.46700000000016

TPSA: 55.84

MolLogP: 3.859600000000003

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