Navigation

name Structure Reference Source Properties Activities Metabolism

Izenamide A

AlkaPlorer ID: AK045632

Synonym: None

IUPAC Name: methyl (2S)-1-[(2R)-2-[[(2S)-2-[[(2S,3S)-2-[[(3S,4S)-3-hydroxy-4-[[(2R)-2-[(2S)-2-hydroxy-3-methylbutanoyl]oxy-3-methylbutanoyl]amino]-6-methylheptanoyl]amino]-3-methylpentanoyl]amino]propanoyl]-methylamino]-3-phenylpropanoyl]pyrrolidine-2-carboxylate

Structure

SMILES: CC[C@H](C)[C@H](N=C(O)C[C@H](O)[C@H](CC(C)C)N=C(O)[C@H](OC(=O)[C@@H](O)C(C)C)C(C)C)C(O)=N[C@@H](C)C(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(=O)OC

copy

InChI: InChI=1S/C43H69N5O11/c1-12-27(8)35(46-34(50)23-33(49)30(21-24(2)3)45-39(53)37(26(6)7)59-43(57)36(51)25(4)5)38(52)44-28(9)40(54)47(10)32(22-29-17-14-13-15-18-29)41(55)48-20-16-19-31(48)42(56)58-11/h13-15,17-18,24-28,30-33,35-37,49,51H,12,16,19-23H2,1-11H3,(H,44,52)(H,45,53)(H,46,50)/t27-,28-,30-,31-,32+,33-,35-,36-,37+/m0/s1

copy

InChIKey: LTKVRJFDYIZQCP-ALAILQQQSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
None Cyanobacterium Geminocystaceae Chroococcales Cyanophyceae Cyanobacteriota None Bacteria

Properties Information

Molecule Weight: 832.0489999999998

TPSA？: 231.45

MolLogP？: 4.643200000000006

Number of H-Donors: 5

Number of H-Acceptors: 11

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Cathepsin D IC50 380.0 nM 10.1021/acs.jnatprod.8b00417
Homo sapiens HeLa GI nan None 10.1021/acs.jnatprod.8b00417
Homo sapiens HL-60 GI nan None 10.1021/acs.jnatprod.8b00417
Homo sapiens MCF7 GI nan None 10.1021/acs.jnatprod.8b00417

Metabolism Information