(Q77493653)

English

JBIR-74

bioactive natural product

In more languages

Statements

type of chemical entity

0 references

biogenic cyclopeptide

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biogenic 2,5-diketopiperazine

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imidazole alkaloid

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248.127325752 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₂H₁₆N₄O₂

0 references

canonical SMILES

CCC(C)C1NC(=O)C(=Cc2cnc[nH]2)NC1=O

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isomeric SMILES

CC[C@H](C)[C@@H]1C(=O)N/C(=C\C2=CN=CN2)/C(=O)N1

0 references

1 reference

Isolation of 2 new metabolites, JBIR-74 and JBIR-75, from the sponge-derived Aspergillus sp. fS14

Identifiers

InChI=1S/C12H16N4O2/c1-3-7(2)10-12(18)15-9(11(17)16-10)4-8-5-13-6-14-8/h4-7,10H,3H2,1-2H3,(H,13,14)(H,15,18)(H,16,17)/b9-4-/t7-,10+/m0/s1

0 references

NDEACPULNGPFLX-RVAOVDKHSA-N

2 references

language of work or name

Natural Product Atlas

language of work or name

2 references

language of work or name

matched by identifier from

NDEACPULNGPFLX-RVAOVDKHSA-N

mapping relation type

1 reference

matched by identifier from

International Chemical Identifier

InChI=1S/C12H16N4O2/c1-3-7(2)10-12(18)15-9(11(17)16-10)4-8-5-13-6-14-8/h4-7,10H,3H2,1-2H3,(H,13,14)(H,15,18)(H,16,17)/b9-4-/t7-,10+/m0/s1

UniChem compound ID

1 reference

Natural Product Atlas ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

NDEACPULNGPFLX-RVAOVDKHSA-N

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