(Q110068909)

English

(4S,8E,10Z)-N-{3-[4-(2-aminoethyl)-2,6-dibromophenoxy]propyl}-9,11-dibromo-4-hydroxy-10-methoxy-1,6-dioxa-2-azaspiro[4.7]dodeca-2,8,10-triene-3-carboxamide

group of stereoisomers with the chemical formula C₂₂H₂₅Br₄N₃O₆

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

742.84768392 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₅Br₄N₃O₆

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canonical SMILES

O=C(NCCCOC1=C(Br)C=C(C=C1Br)CCN)C2=NOC3(OCC=C(Br)C(OC)=C(Br)C3)C2O

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isomeric SMILES

COC1=C(/Br)CC2(OC\C=C/1Br)ON=C(C(=O)NCCCOc1c(Br)cc(CCN)cc1Br)[C@@H]2O

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found in taxon

Pseudoceratina purpurea

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stated in

Recent research in marine natural products from the Red Sea

stated in

Structure of the psammaplysins

stated in

Ceratinamides A and B: New antifouling dibromotyrosine derivatives from the marine sponge Pseudoceratina purpurea

stated in

Psammaplysin C: a new cytotoxic dibromotyrosine-derived metabolite from the marine sponge Druinella (= Psammaplysilla) purpurea

Pseudoceratina arabica

1 reference

stated in

Bioactive brominated metabolites from the Red Sea sponge Pseudoceratina arabica.

Aplysinella

1 reference

stated in

Psammaplysin F, a New Bromotyrosine Derivative from a Sponge, Aplysinella sp

Identifiers

InChI

InChI=1S/C22H25Br4N3O6/c1-32-18-13(23)4-8-34-22(11-16(18)26)20(30)17(29-35-22)21(31)28-6-2-7-33-19-14(24)9-12(3-5-27)10-15(19)25/h4,9-10,20,30H,2-3,5-8,11,27H2,1H3,(H,28,31)/b13-4+,18-16+/t20-,22?/m0/s1

(Q110068909)

(4S,8E,10Z)-N-{3-[4-(2-aminoethyl)-2,6-dibromophenoxy]propyl}-9,11-dibromo-4-hydroxy-10-methoxy-1,6-dioxa-2-azaspiro[4.7]dodeca-2,8,10-triene-3-carboxamide

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Identifiers

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