(Q105346173)

English

5,16,21,32,36-Pentabromo-4,20-dihydroxy-12,25-bis(hydroxyimino)-2,18-dioxa-10,27-diazapentacyclo[28.2.2.214,17.13,7.119,23]octatriaconta-1(32),3,5,7(38),14,16,19,21,23(35),28,30,33,36-tridecaene-11,26-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

phenethylamine alkaloid

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mass

1,011.75892426 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₄H₂₅Br₅N₄O₈

0 references

canonical SMILES

O=C1NC=CC=2C=CC(OC3=CC(=CC(Br)=C3O)CCNC(=O)C(=NO)CC4=CC(Br)=C(OC5=CC(=CC(Br)=C5O)CC1=NO)C(Br)=C4)=C(Br)C2

0 references

found in taxon

Ianthella basta

3 references

stated in

Brominated tyrosine-derived metabolites from the sponge Ianthella basta.

stated in

New bastadins from the sponge Ianthella basta

stated in

Cytotoxic bastadin 24 from the Australian sponge Ianthella quadrangulata

Ianthella quadrangulata

1 reference

stated in

Cytotoxic bastadin 24 from the Australian sponge Ianthella quadrangulata

Identifiers

InChI

InChI=1S/C34H25Br5N4O8/c35-20-7-16-1-2-27(20)50-28-14-17(8-21(36)30(28)44)4-6-41-33(46)25(42-48)12-18-10-23(38)32(24(39)11-18)51-29-15-19(9-22(37)31(29)45)13-26(43-49)34(47)40-5-3-16/h1-3,5,7-11,14-15,44-45,48-49H,4,6,12-13H2,(H,40,47)(H,41,46)

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InChIKey

YCBNAUHIFJRIQW-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YCBNAUHIFJRIQW-UHFFFAOYSA-N

1 reference

(Q105346173)

5,16,21,32,36-Pentabromo-4,20-dihydroxy-12,25-bis(hydroxyimino)-2,18-dioxa-10,27-diazapentacyclo[28.2.2.214,17.13,7.119,23]octatriaconta-1(32),3,5,7(38),14,16,19,21,23(35),28,30,33,36-tridecaene-11,26-dione

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Identifiers

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