Molecule

thiomarinol F

AlkaPlorer ID: AK041773

Synonym: '', 'Thiomarinol F', '182155-01-7'

IUPAC Name: [8-oxo-8-[(5-oxo-4H-dithiolo[4,3-b]pyrrol-6-yl)amino]octyl] (E,4R)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[(E,4R)-4-methyl-5-oxohex-2-enyl]oxan-2-yl]-4-hydroxy-3-methylbut-2-enoate

Structure

SMILES: CC(=O)[C@H](C)/C=C/C[C@H]1CO[C@@H]([C@H](O)/C(C)=C/C(=O)OCCCCCCCC(O)=NC2=C3SSC=C3N=C2O)[C@H](O)[C@@H]1O

InChI: InChI=1S/C30H42N2O9S2/c1-17(19(3)33)10-9-11-20-15-41-28(27(38)26(20)37)25(36)18(2)14-23(35)40-13-8-6-4-5-7-12-22(34)32-24-29-21(16-42-43-29)31-30(24)39/h9-10,14,16-17,20,25-28,36-38H,4-8,11-13,15H2,1-3H3,(H,31,39)(H,32,34)/b10-9+,18-14+/t17-,20+,25-,26-,27-,28+/m1/s1

InChIKey: FALNLLBJTDMUIP-KJTKGZELSA-N

Reference

Thiomarinols D, E, F and G, New Hybrid Antimicrobial Antibiotics Produced by a Marine Bacterium;Isolation, Structure, and Antimicrobial Activity.

PubChem CID: 70697762

LOTUS: LTS0085772

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	None	Alteromonadaceae	Alteromonadales	Gammaproteobacteria	Pseudomonadota	None	Bacteria

Properties Information

Molecule Weight: 638.8050000000005

TPSA？: 178.99999999999997

MolLogP？: 4.702200000000007

Number of H-Donors: 5

Number of H-Acceptors: 12

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi