Mortiamide C
AlkaPlorer ID: AK109617
Synonym: None
IUPAC Name: (3S,6R,9R,12R,15S,18R,21R)-3-benzyl-15-[(2S)-butan-2-yl]-6,12,21-tris[(2R)-butan-2-yl]-18-methyl-9-propan-2-yl-1,4,7,10,13,16,19-heptazacyclohenicosane-2,5,8,11,14,17,20-heptone
Structure
SMILES: CC[C@@H](C)[C@H]1N=C(O)[C@H](CC2=CC=CC=C2)N=C(O)[C@@H]([C@H](C)CC)N=C(O)[C@@H](C(C)C)N=C(O)[C@@H]([C@H](C)CC)N=C(O)[C@H]([C@@H](C)CC)N=C(O)[C@@H](C)N=C1O
InChI: InChI=1S/C41H67N7O7/c1-12-23(7)31-38(52)42-27(11)35(49)45-33(25(9)14-3)41(55)48-34(26(10)15-4)40(54)44-30(22(5)6)37(51)47-32(24(8)13-2)39(53)43-29(36(50)46-31)21-28-19-17-16-18-20-28/h16-20,22-27,29-34H,12-15,21H2,1-11H3,(H,42,52)(H,43,53)(H,44,54)(H,45,49)(H,46,50)(H,47,51)(H,48,55)/t23-,24-,25+,26-,27-,29+,30-,31-,32-,33+,34-/m1/s1
InChIKey: APKNPYLTWRYLIE-UXQKBCBTSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mortierella sp. | Mortierella | Mortierellaceae | Mortierellales | Mortierellomycetes | Mucoromycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 770.0289999999999
TPSA？: 228.13
MolLogP？: 8.37870000000001
Number of H-Donors: 7
Number of H-Acceptors: 7
RingCount: 2
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 |