(Q110178254)

English

(4R,5R)-N-[3-[4-(2-amino-1-hydroxyethyl)-2,6-dibromophenoxy]propyl]-7,9-dibromo-4-hydroxy-8-methoxy-1,11-dioxa-2-azaspiro[4.6]undeca-2,7,9-triene-3-carboxamide

group of stereoisomers with the chemical formula C₂₁H₂₃Br₄N₃O₇

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

744.826948476 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₃Br₄N₃O₇

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canonical SMILES

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

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isomeric SMILES

COC1=C(Br)C[C@@]2(OC=C1Br)ON=C(C(=O)NCCCOc1c(Br)cc(C(O)CN)cc1Br)[C@H]2O

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found in taxon

Suberea

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stated in

Cytotoxic psammaplysin analogues from a Suberea sp. marine sponge and the role of the spirooxepinisoxazoline in their activity.

Identifiers

InChI

InChI=1S/C21H23Br4N3O7/c1-32-17-13(24)7-21(34-9-14(17)25)19(30)16(28-35-21)20(31)27-3-2-4-33-18-11(22)5-10(6-12(18)23)15(29)8-26/h5-6,9,15,19,29-30H,2-4,7-8,26H2,1H3,(H,27,31)/t15?,19-,21-/m1/s1

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InChIKey

REZAYKBREJXSAG-AIEAQGLASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

REZAYKBREJXSAG-AIEAQGLASA-N

1 reference

(Q110178254)

(4R,5R)-N-[3-[4-(2-amino-1-hydroxyethyl)-2,6-dibromophenoxy]propyl]-7,9-dibromo-4-hydroxy-8-methoxy-1,11-dioxa-2-azaspiro[4.6]undeca-2,7,9-triene-3-carboxamide

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