Results for:
PubChem ID: 635282

9,10lambda4,11,20,21lambda4,28-hexathianonacyclo[19.6.1.02,7.08,26.010,25.012,24.013,18.019,23.022,27]octacosa-1(27),2,4,6,8(26),10(25),12(24),13,15,17,19(23),21-dodecaene

Compound Details

Synonymous names
Pentacene, 5,6,7:12,13,14-hexathio-
SCHEMBL13105906
ONQYBGIGVGXVSC-UHFFFAOYSA-N
Microorganism:

Yes

IUPAC name9,10lambda4,11,20,21lambda4,28-hexathianonacyclo[19.6.1.02,7.08,26.010,25.012,24.013,18.019,23.022,27]octacosa-1(27),2,4,6,8(26),10(25),12(24),13,15,17,19(23),21-dodecaene
SMILESC1=CC=C2C(=C1)C3=C4C5=C2SS6=C5C7=C(S6)C8=CC=CC=C8C9=C7C4=S(S3)S9
InchiInChI=1S/C22H8S6/c1-2-6-10-9(5-1)17-13-14-18(10)24-28-22(14)16-15-19(25-27(23-17)21(13)15)11-7-3-4-8-12(11)20(16)26-28/h1-8H
FormulaC22H8S6
PubChem ID635282
Molweight464.7
LogP6.9
Atoms28
Bonds0
H-bond Acceptor6
H-bond Donor0
Chemical Classificationaromatic compounds benzenoids sulfur compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Pectobacterium CarotovorumKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Pectobacterium Carotovoruminoculated potato samplesGC-MSno