Molecule

Gliotoxin; Tetrathia homologue

AlkaPlorer ID: AK299281

Synonym: Gliotoxin G

IUPAC Name: 7-hydroxy-11-(hydroxymethyl)-17-methyl-12,13,14,15-tetrathia-9,17-diazatetracyclo[9.4.2.01,9.03,8]heptadeca-3,5-diene-10,16-dione

SMILES: CN1C(=O)C23CC4=CC=CC(O)C4N2C(=O)C1(CO)SSSS3

InChI: InChI=1S/C13H14N2O4S4/c1-14-10(18)12-5-7-3-2-4-8(17)9(7)15(12)11(19)13(14,6-16)21-23-22-20-12/h2-4,8-9,16-17H,5-6H2,1H3

InChIKey: TZBWGHOEGGDHNR-UHFFFAOYSA-N

PubChem CID: 13989146

LOTUS: LTS0127459

COCONUT: CNP0187479.3

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Aspergillus fumigatus	Aspergillus	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
None	Penicillium	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
Thermoascus crustaceus	Thermoascus	Thermoascaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
None	Gliocladium	None	Hypocreales	Sordariomycetes	Ascomycota	Fungi	Eukaryota
None	Trichoderma	Hypocreaceae	Hypocreales	Sordariomycetes	Ascomycota	Fungi	Eukaryota
None	Penicillium	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
None	Trichoderma	Hypocreaceae	Hypocreales	Sordariomycetes	Ascomycota	Fungi	Eukaryota

Molecule Weight: 390.533

TPSA？: 81.08000000000001

MolLogP？: 0.9927000000000004

Number of H-Donors: 2

Number of H-Acceptors: 8

RingCount: 5

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi