(Q105208243)

English

(3S)-3alpha-(1H-Indole-3-ylmethyl)-6alpha-[2-(1,1-dimethyl-2-propenyl)-1H-indole-3-ylmethyl]piperazine-2,5-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

3-(1H-indol-3-ylmethyl)-6-[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methyl]piperazine-2,5-dione

1 reference

based on heuristic

inferred from SMILES

mass

440.221226136 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

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

1 reference

based on heuristic

inferred from InChIKey

1 reference

C₂₇H₂₈N₄O₂

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canonical SMILES

C=CC(C)(C)c1[nH]c2ccccc2c1CC1NC(=O)C(Cc2c[nH]c3ccccc23)NC1=O

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isomeric SMILES

C=CC(C)(C)c1[nH]c2ccccc2c1C[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O

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found in taxon

Penicillium simplicissimum

1 reference

stated in

New Okaramine Congeners, Okamines J, K, L, M and Related Compounds, fromPenicillium simplicissimumATCC 90288

Penicillium dierckxii

1 reference

stated in

New diketopiperazine alkaloids from Penicillium fellutanum

Identifiers

InChI

InChI=1S/C27H28N4O2/c1-4-27(2,3)24-19(18-10-6-8-12-21(18)29-24)14-23-26(33)30-22(25(32)31-23)13-16-15-28-20-11-7-5-9-17(16)20/h4-12,15,22-23,28-29H,1,13-14H2,2-3H3,(H,30,33)(H,31,32)/t22-,23-/m0/s1

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InChIKey

PFYKDKMYQRWRGF-GOTSBHOMSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

PFYKDKMYQRWRGF-GOTSBHOMSA-N

1 reference

(Q105208243)

(3S)-3alpha-(1H-Indole-3-ylmethyl)-6alpha-[2-(1,1-dimethyl-2-propenyl)-1H-indole-3-ylmethyl]piperazine-2,5-dione

Statements

Identifiers

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