Flueggenine D

AlkaPlorer ID: AK000602

Synonym: None

IUPAC Name: (1S,8S,13R)-4-[(1S,7R,8S,13R)-3-oxo-2-oxa-9-azatetracyclo[6.5.1.01,5.09,13]tetradec-4-en-7-yl]-2-oxa-9-azatetracyclo[6.5.1.01,5.09,13]tetradeca-4,6-dien-3-one

Structure

SMILES: C1C[C@@H]2[C@]34C[C@H](N2C1)C=CC3=C(C(=O)O4)[C@H]5CC6=CC(=O)O[C@@]67C[C@@H]5N8[C@@H]7CCC8

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InChI: InChI=1S/C24H26N2O4/c27-20-10-13-9-15(17-12-23(13,29-20)18-3-2-8-26(17)18)21-16-6-5-14-11-24(16,30-22(21)28)19-4-1-7-25(14)19/h5-6,10,14-15,17-19H,1-4,7-9,11-12H2/t14-,15+,17+,18-,19-,23+,24+/m1/s1

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InChIKey: NQFIEVOKDJZASR-ISNYVNCWSA-N

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Properties Information

Molecule Weight: 406.48200000000026

TPSA: 59.080000000000005

MolLogP: 1.8636999999999997

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information