Paeciloxazine

AlkaPlorer ID: AK309167

Synonym: None

IUPAC Name: [2-acetyloxy-3,8-dimethyl-5-(2-methyloxiran-2-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl] 9b-hydroxy-5-methyl-1,2,3,3a-tetrahydropyrrolo[2,3-c][2,1]benzoxazine-2-carboxylate

Structure

SMILES: CC(=O)OC1C(C)=CC2C(C(C)CCC2C2(C)CO2)C1OC(=O)C1CC2(O)C3=CC=CC=C3N(C)OC2N1

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InChI: InChI=1S/C29H38N2O7/c1-15-10-11-19(28(4)14-35-28)18-12-16(2)24(36-17(3)32)25(23(15)18)37-26(33)21-13-29(34)20-8-6-7-9-22(20)31(5)38-27(29)30-21/h6-9,12,15,18-19,21,23-25,27,30,34H,10-11,13-14H2,1-5H3

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InChIKey: RMGVCOCXWDORPG-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Paecilomyces sp. Paecilomyces Thermoascaceae Eurotiales Eurotiomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 526.6300000000002

TPSA: 109.86

MolLogP: 2.8144

Number of H-Donors: 2

Number of H-Acceptors: 9

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information