(Q105192286)

English

[(1S,4R,5S,12S,15S,16R)-16-acetyloxy-2,13-dioxo-8,19-dioxa-23,24-dithia-3,14-diazahexacyclo[10.10.2.01,14.03,12.04,10.015,21]tetracosa-6,9,17,20-tetraen-5-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

biogenic 2,5-diketopiperazine

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mass

504.0661076 dalton

1 reference

1 reference

C₂₂H₂₀N₂O₈S₂

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canonical SMILES

O=C(OC1C=COC=C2CC34SSC5(C(=O)N3C21)N(C4=O)C6C(=COC=CC6OC(=O)C)C5)C

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isomeric SMILES

CC(=O)O[C@H]1C=COC=C2C[C@]34SS[C@@]5(CC6=COC=C[C@@H](OC(C)=O)[C@H]6N5C3=O)C(=O)N4[C@H]21

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found in taxon

Aspergillus terreus

1 reference

stated in

Isolation of Acetylaranotin, Bisdethiodi(methylthio)-acetylaranotin and Terrein as Plant Growth Inhibitors from a Strain ofAspergillus terreus

Identifiers

InChI

InChI=1S/C22H20N2O8S2/c1-11(25)31-15-3-5-29-9-13-7-21-20(28)24-18-14(10-30-6-4-16(18)32-12(2)26)8-22(24,34-33-21)19(27)23(21)17(13)15/h3-6,9-10,15-18H,7-8H2,1-2H3/t15-,16+,17+,18-,21-,22-/m0/s1

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InChIKey

OHTZNUUGYPDWEB-MVCAKEEGSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OHTZNUUGYPDWEB-MVCAKEEGSA-N

(Q105192286)

[(1S,4R,5S,12S,15S,16R)-16-acetyloxy-2,13-dioxo-8,19-dioxa-23,24-dithia-3,14-diazahexacyclo[10.10.2.01,14.03,12.04,10.015,21]tetracosa-6,9,17,20-tetraen-5-yl] acetate

Statements

Identifiers

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