(Q105134800)

English

(1R,9S)-11-hydroxy-14-(1H-imidazol-5-ylmethylidene)-2-methoxy-9-(2-methylbut-3-en-2-yl)-2,13,16-triazatetracyclo[7.7.0.01,13.03,8]hexadeca-3,5,7,10-tetraene-12,15-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

imidazole alkaloid

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mass

433.175004216 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,9S,14Z)-11-hydroxy-14-(1H-imidazol-5-ylmethylidene)-2-methoxy-9-(2-methylbut-3-en-2-yl)-2,13,16-triazatetracyclo[7.7.0.01,13.03,8]hexadeca-3,5,7,10-tetraene-12,15-dione

1 reference

1 reference

1 reference

(1S,9R,14Z)-11-hydroxy-14-(1H-imidazol-5-ylmethylidene)-2-methoxy-9-(2-methylbut-3-en-2-yl)-2,13,16-triazatetracyclo[7.7.0.01,13.03,8]hexadeca-3,5,7,10-tetraene-12,15-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₃H₂₃N₅O₄

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canonical SMILES

O=C1NC23N(OC)C=4C=CC=CC4C3(C=C(O)C(=O)N2C1=CC=5N=CNC5)C(C=C)(C)C

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isomeric SMILES

C=CC(C)(C)[C@]12C=C(O)C(=O)N3C(=Cc4c[nH]cn4)C(=O)N[C@@]31N(OC)c1ccccc12

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found in taxon

Penicillium oxalicum

1 reference

stated in

Use of experimental design for the optimization of the production of new secondary metabolites by two Penicillium species.

Identifiers

InChI

InChI=1S/C23H23N5O4/c1-5-21(2,3)22-11-18(29)20(31)27-17(10-14-12-24-13-25-14)19(30)26-23(22,27)28(32-4)16-9-7-6-8-15(16)22/h5-13,29H,1H2,2-4H3,(H,24,25)(H,26,30)/t22-,23-/m1/s1

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InChIKey

JTJJJLSLKZFEPJ-DHIUTWEWSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JTJJJLSLKZFEPJ-DHIUTWEWSA-N

(Q105134800)

(1R,9S)-11-hydroxy-14-(1H-imidazol-5-ylmethylidene)-2-methoxy-9-(2-methylbut-3-en-2-yl)-2,13,16-triazatetracyclo[7.7.0.01,13.03,8]hexadeca-3,5,7,10-tetraene-12,15-dione

Statements

Identifiers

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