Molecule

Scyphostatin

AlkaPlorer ID: AK313157

Synonym: F 10463A, Antibiotic F 10463A

IUPAC Name: N-[1-hydroxy-3-(2-hydroxy-3-oxo-7-oxabicyclo[4.1.0]hept-4-en-2-yl)propan-2-yl]-8,10,12,14-tetramethylhexadeca-2,4,6,12-tetraenamide

Structure

SMILES: CCC(C)C=C(C)CC(C)CC(C)C=CC=CC=CC(O)=NC(CO)CC1(O)C(=O)C=CC2OC21

InChI: InChI=1S/C29H43NO5/c1-6-20(2)15-22(4)17-23(5)16-21(3)11-9-7-8-10-12-27(33)30-24(19-31)18-29(34)26(32)14-13-25-28(29)35-25/h7-15,20-21,23-25,28,31,34H,6,16-19H2,1-5H3,(H,30,33)

InChIKey: KSIWZCYBCSQXTA-UHFFFAOYSA-N

Reference

Scyphostatin, a Neutral Sphingomyelinase Inhibitor from a Discomycete, Trichopeziza mollissima: Taxonomy of the Producing Organism, Fermentation, Isolation, and Physico-chemical roperties.

PubChem CID: 72768463

CAS: 169062-93-5

LOTUS: LTS0192348

COCONUT: CNP0233089.5

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Dasyscyphus	Lachnaceae	Helotiales	Leotiomycetes	Ascomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 485.66500000000025

TPSA？: 102.65

MolLogP？: 5.044700000000006

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi