Asporyzin B

AlkaPlorer ID: AK078757

Synonym: None

IUPAC Name: (1S,2S,5S,7R,9S,10R,13S)-15-hydroxy-1,2,9-trimethyl-7-(2-methylprop-1-enyl)-6-oxa-22-azahexacyclo[11.10.0.02,10.05,9.015,22.016,21]tricosa-16,18,20-trien-23-one

Structure

SMILES: CC(C)=C[C@H]1C[C@]2(C)[C@H](CC[C@@]3(C)[C@H]2CC[C@H]2CC4(O)C5=CC=CC=C5N4C(=O)[C@@]23C)O1

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InChI: InChI=1S/C28H37NO3/c1-17(2)14-19-16-25(3)22-11-10-18-15-28(31)20-8-6-7-9-21(20)29(28)24(30)27(18,5)26(22,4)13-12-23(25)32-19/h6-9,14,18-19,22-23,31H,10-13,15-16H2,1-5H3/t18-,19-,22-,23-,25-,26-,27+,28?/m0/s1

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InChIKey: SPCHXPAJDYUPBJ-QFRRQRMOSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Aspergillus oryzae Aspergillus Aspergillaceae Eurotiales Eurotiomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 435.6080000000001

TPSA: 49.77

MolLogP: 5.544600000000006

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information