(Q105027131)

English

5-chloro-6-hydroxy-3-methoxyspiro[3H-1-benzofuran-2,2'-6,7-dithia-1,4-diazabicyclo[3.2.1]octane]-3',8'-dione

group of stereoisomers with the chemical formula C₁₂H₉ClN₂O₅S₂

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Statements

instance of

group of stereoisomers

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subclass of

biogenic 2,5-diketopiperazine

1 reference

inferred from

biogenic 2,5-diketopiperazine

mass

359.964141068 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₂H₉ClN₂O₅S₂

0 references

canonical SMILES

COC1c2cc(Cl)c(O)cc2OC12C(=O)NC1SSN2C1=O

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found in taxon

Aspergillus oryzae

1 reference

stated in

Isolation of aspirochlorine (=antibiotic A30641) as a true antimicrobial constituent of the antibiotic, oryzachlorin, from Aspergillus oryzae.

Identifiers

InChI

InChI=1S/C12H9ClN2O5S2/c1-19-8-4-2-5(13)6(16)3-7(4)20-12(8)11(18)14-9-10(17)15(12)22-21-9/h2-3,8-9,16H,1H3,(H,14,18)

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InChIKey

HEXYWHYANGOMLJ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HEXYWHYANGOMLJ-UHFFFAOYSA-N

(Q105027131)

5-chloro-6-hydroxy-3-methoxyspiro[3H-1-benzofuran-2,2'-6,7-dithia-1,4-diazabicyclo[3.2.1]octane]-3',8'-dione

Statements

Identifiers

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