Antibiotic PF 1070A

AlkaPlorer ID: AK288596

Synonym: PF 1070A

IUPAC Name: 6-benzyl-3-butan-2-yl-9-[6-(oxiran-2-yl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

Structure

SMILES: CCC(C)C1N=C(O)C(CC2=CC=CC=C2)N=C(O)C(CCCCCC(=O)C2CO2)N=C(O)C2CCCCN2C1=O

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InChI: InChI=1S/C31H44N4O6/c1-3-20(2)27-31(40)35-17-11-10-15-24(35)30(39)32-22(14-8-5-9-16-25(36)26-19-41-26)28(37)33-23(29(38)34-27)18-21-12-6-4-7-13-21/h4,6-7,12-13,20,22-24,26-27H,3,5,8-11,14-19H2,1-2H3,(H,32,39)(H,33,37)(H,34,38)

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InChIKey: IEIMOAHNLVBBHL-UHFFFAOYSA-N

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Reference

PubChem CID: 9872767

CAS: 146556-41-4

COCONUT: CNP0286769.2

Source

Species Genus Family Order Class Phylum Kingdom Domain
Humicola sp. Humicola Chaetomiaceae Sordariales Sordariomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 568.7150000000004

TPSA: 147.68

MolLogP: 4.563600000000004

Number of H-Donors: 3

Number of H-Acceptors: 6

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information