Serratiomycin
AlkaPlorer ID: AK017904
Synonym: None
IUPAC Name: (3S,6S,9R,12R,15R,19R)-6-benzyl-3-butan-2-yl-19-heptyl-9-[(1S)-1-hydroxyethyl]-12-(hydroxymethyl)-15-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone
Structure
SMILES: CCCCCCC[C@@H]1CC(O)=N[C@H](CC(C)C)C(O)=N[C@H](CO)C(O)=N[C@H]([C@H](C)O)C(O)=N[C@@H](CC2=CC=CC=C2)C(O)=N[C@@H](C(C)CC)C(=O)O1
InChI: InChI=1S/C38H61N5O9/c1-7-9-10-11-15-18-27-21-31(46)39-28(19-23(3)4)34(47)41-30(22-44)36(49)43-33(25(6)45)37(50)40-29(20-26-16-13-12-14-17-26)35(48)42-32(24(5)8-2)38(51)52-27/h12-14,16-17,23-25,27-30,32-33,44-45H,7-11,15,18-22H2,1-6H3,(H,39,46)(H,40,50)(H,41,47)(H,42,48)(H,43,49)/t24?,25-,27+,28+,29-,30+,32-,33+/m0/s1
InChIKey: JJJUZZODDZXKCZ-YRMLTHTPSA-N
Reference
Serratiomycin, a new antibacterial peptolide from an eubacterium culture, MB 5691
PubChem CID: 139583233
LOTUS: LTS0030071
{NPAtlas: NPA000532
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Eubacterium sp. | Eubacterium | Eubacteriaceae | Eubacteriales | Clostridia | Bacillota | None | Bacteria |
Properties Information
Molecule Weight: 731.9320000000001
TPSA？: 229.70999999999995
MolLogP？: 5.995900000000004
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|