(Q105208314)

English

(3R,6S)-3-[(2S)-butan-2-yl]-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione

chemical compound

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type of chemical entity

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1 reference

3-butan-2-yl-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione

1 reference

based on heuristic

inferred from SMILES

mass

299.163376912 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3R,6R)-3-[(2S)-butan-2-yl]-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₁N₃O₂

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canonical SMILES

CCC(C)C1NC(=O)C(Cc2c[nH]c3ccccc23)NC1=O

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isomeric SMILES

CC[C@H](C)[C@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O

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found in taxon

Penicillium brevicompactum

1 reference

stated in

Brevicompanine C, Cyclo-(d-Ile-l-Trp), and Cyclo-(d-Leu-l-Trp), Plant Growth Regulators fromPenicilliumbrevi-compactum

Identifiers

InChI

InChI=1S/C17H21N3O2/c1-3-10(2)15-17(22)19-14(16(21)20-15)8-11-9-18-13-7-5-4-6-12(11)13/h4-7,9-10,14-15,18H,3,8H2,1-2H3,(H,19,22)(H,20,21)/t10-,14-,15+/m0/s1

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InChIKey

PGCNHGBQEYFZEX-NZVBXONLSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PGCNHGBQEYFZEX-NZVBXONLSA-N

1 reference

(Q105208314)

(3R,6S)-3-[(2S)-butan-2-yl]-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione

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