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Mortiamide A

AlkaPlorer ID: AK109607

Synonym: None

IUPAC Name: (3S,6R,9R,12S,15R,18R,21R)-3,6-dibenzyl-12-(2-methylpropyl)-9,15,18,21-tetra(propan-2-yl)-1,4,7,10,13,16,19-heptazacyclohenicosane-2,5,8,11,14,17,20-heptone

Structure

SMILES: CC(C)C[C@@H]1N=C(O)[C@@H](C(C)C)N=C(O)[C@@H](C(C)C)N=C(O)[C@@H](C(C)C)N=C(O)[C@H](CC2=CC=CC=C2)N=C(O)[C@@H](CC2=CC=CC=C2)N=C(O)[C@@H](C(C)C)N=C1O

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InChI: InChI=1S/C44H65N7O7/c1-24(2)21-31-39(53)48-34(25(3)4)41(55)47-32(22-29-17-13-11-14-18-29)38(52)45-33(23-30-19-15-12-16-20-30)40(54)49-36(27(7)8)43(57)51-37(28(9)10)44(58)50-35(26(5)6)42(56)46-31/h11-20,24-28,31-37H,21-23H2,1-10H3,(H,45,52)(H,46,56)(H,47,55)(H,48,53)(H,49,54)(H,50,58)(H,51,57)/t31-,32+,33-,34+,35+,36+,37+/m0/s1

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InChIKey: MSKMUAPCBKXDPR-LJDNFWMJSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Mortierella sp. Mortierella Mortierellaceae Mortierellales Mortierellomycetes Mucoromycota Fungi Eukaryota

Properties Information

Molecule Weight: 804.046

TPSA？: 228.13

MolLogP？: 8.431200000000008

Number of H-Donors: 7

Number of H-Acceptors: 7

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Candida albicans Candida albicans Activity None None 10.1021/acs.jnatprod.7b00383
Enterococcus faecium Enterococcus faecium Activity None None 10.1021/acs.jnatprod.7b00383
Homo sapiens BJ Activity None None 10.1021/acs.jnatprod.7b00383
Homo sapiens Keratinocyte Activity None None 10.1021/acs.jnatprod.7b00383
Homo sapiens MCF7 Activity None None 10.1021/acs.jnatprod.7b00383
Pseudomonas aeruginosa Pseudomonas aeruginosa Activity None None 10.1021/acs.jnatprod.7b00383
Staphylococcus aureus Staphylococcus aureus Activity None None 10.1021/acs.jnatprod.7b00383
Staphylococcus warneri Staphylococcus warneri Activity None None 10.1021/acs.jnatprod.7b00383
None Unchecked Activity None None 10.1021/acs.jnatprod.7b00383

Metabolism Information