(Q105158082)

English

(3S,6S)-3,6-Bis-(4-hydroxy-benzyl)-1,4-dimethyl-piperazine-2,5-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

3,6-Bis[(4-hydroxyphenyl)methyl]-1,4-dimethylpiperazine-2,5-dione

1 reference

based on heuristic

inferred from SMILES

mass

354.157957184 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₂N₂O₄

0 references

canonical SMILES

O=C1N(C)C(C(=O)N(C)C1CC2=CC=C(O)C=C2)CC3=CC=C(O)C=C3

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isomeric SMILES

CN1C(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)[C@@H]1Cc1ccc(O)cc1

0 references

found in taxon

Streptomyces griseus

2 references

stated in

Synthesis of a reported calpain inhibitor isolated from Streptomyces griseus.

stated in

Isolation and structure elucidation of two new calpain inhibitors from Streptomyces griseus

Identifiers

InChI

InChI=1S/C20H22N2O4/c1-21-17(11-13-3-7-15(23)8-4-13)20(26)22(2)18(19(21)25)12-14-5-9-16(24)10-6-14/h3-10,17-18,23-24H,11-12H2,1-2H3/t17-,18-/m0/s1

0 references

InChIKey

LVVOUDOWZDIZFR-ROUUACIJSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

LVVOUDOWZDIZFR-ROUUACIJSA-N

ChEBI ID

203500

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C20H22N2O4/c1-21-17(11-13-3-7-15(23)8-4-13)20(26)22(2)18(19(21)25)12-14-5-9-16(24)10-6-14/h3-10,17-18,23-24H,11-12H2,1-2H3/t17-,18-/m0/s1

1 reference

Natural Product Atlas ID

NPA006463

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

LVVOUDOWZDIZFR-ROUUACIJSA-N

(Q105158082)

(3S,6S)-3,6-Bis-(4-hydroxy-benzyl)-1,4-dimethyl-piperazine-2,5-dione

Statements

Identifiers

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