Minutissamide G
AlkaPlorer ID: AK007773
Synonym: None
IUPAC Name: 3-[(3S,6S,9R,12S,15S,18S,21E,24S,27R,28R,31S)-3-(2-amino-2-oxoethyl)-21-ethylidene-27-hydroxy-15,18-bis[(1R)-1-hydroxyethyl]-28-[(2S)-13-hydroxyhexadecan-2-yl]-6-[(1R)-1-methoxyethyl]-4,9-dimethyl-2,5,8,11,14,17,20,23,26,30-decaoxo-24-propan-2-yl-1,4,7,10,13,16,19,22,25,29-decazabicyclo[29.3.0]tetratriacontan-12-yl]propanamide
Structure
SMILES: C/C=C1/N=C(O)[C@H](C(C)C)N=C(O)[C@H](O)[C@@H]([C@@H](C)CCCCCCCCCCC(O)CCC)N=C(O)[C@@H]2CCCN2C(=O)[C@H](CC(=N)O)N(C)C(=O)[C@H]([C@@H](C)OC)N=C(O)[C@@H](C)N=C(O)[C@H](CCC(=N)O)N=C(O)[C@H]([C@@H](C)O)N=C(O)[C@H]([C@@H](C)O)N=C1O
InChI: InChI=1S/C59H102N12O17/c1-12-23-37(74)25-21-19-17-15-14-16-18-20-24-32(5)45-49(77)57(85)65-44(31(3)4)54(82)63-38(13-2)51(79)67-47(35(8)73)56(84)68-46(34(7)72)55(83)64-39(27-28-42(60)75)52(80)62-33(6)50(78)69-48(36(9)88-11)59(87)70(10)41(30-43(61)76)58(86)71-29-22-26-40(71)53(81)66-45/h13,31-37,39-41,44-49,72-74,77H,12,14-30H2,1-11H3,(H2,60,75)(H2,61,76)(H,62,80)(H,63,82)(H,64,83)(H,65,85)(H,66,81)(H,67,79)(H,68,84)(H,69,78)/b38-13+/t32-,33+,34+,35+,36+,37?,39-,40-,41-,44-,45+,46-,47-,48-,49+/m0/s1
InChIKey: DJGAMFBGLLUORT-BVKVIBLSSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Anabaena sp. | Anabaena | Nostocaceae | Nostocales | Cyanophyceae | Cyanobacteriota | None | Bacteria |
Properties Information
Molecule Weight: 1251.5320000000002
TPSA？: 479.6500000000002
MolLogP？: 6.7262400000000175
Number of H-Donors: 16
Number of H-Acceptors: 17
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Acinetobacter baumannii | Acinetobacter baumannii | Activity | nan | None | 10.1016/j.bmc.2012.08.017 |
| Enterococcus faecalis | Enterococcus faecalis | Activity | nan | None | 10.1016/j.bmc.2012.08.017 |
| Escherichia coli | Escherichia coli | Activity | nan | None | 10.1016/j.bmc.2012.08.017 |
| Homo sapiens | MDA-MB-435 | IC50 | 9900.0 | nM | 10.1016/j.bmc.2012.08.017 |
| Mycolicibacterium smegmatis | Mycolicibacterium smegmatis | Activity | nan | None | 10.1016/j.bmc.2012.08.017 |
| Pseudomonas aeruginosa | Pseudomonas aeruginosa | Activity | nan | None | 10.1016/j.bmc.2012.08.017 |
| Staphylococcus aureus | Staphylococcus aureus | Activity | nan | None | 10.1016/j.bmc.2012.08.017 |
| Streptococcus pneumoniae | Streptococcus pneumoniae | Activity | nan | None | 10.1016/j.bmc.2012.08.017 |