(Q27154924)

Aerophobin 2 (English)

9 October 2016

canonical SMILES

COC1=C(C(C2(CC(=NO2)C(=O)NCCCC3=CN=C(N3)N)C=C1Br)O)Br

1 reference

Aerophobin 2 (English)

9 October 2016

isomeric SMILES

COC1=C([C@@H]([C@]2(CC(=NO2)C(=O)NCCCC3=CN=C(N3)N)C=C1Br)O)Br

1 reference

Organ-specific distribution of dietary alkaloids in the marine opisthobranch Tylodina perversa

Aerophobin 2 (English)

9 October 2016

6 references

Antibiotic and cytotoxic activity of brominated compounds from the marine sponge Verongia aerophoba

Chemistry of verongida sponges VIII1-bromocompounds from the mediterranean sponges Aplysina aerophoba and Aplysina cavernicola

The bromo-compounds of the true spongeVerongia aerophoba

Chemistry of verongida sponges VIII1-bromocompounds from the mediterranean sponges Aplysina aerophoba and Aplysina cavernicola

The bromo-compounds of the true spongeVerongia aerophoba

Tylodina perversa

1 reference

Organ-specific distribution of dietary alkaloids in the marine opisthobranch Tylodina perversa

Aiolochroia crassa

1 reference

A New Bromotyrosine Alkaloid from the Caribbean Sponge Aiolochroia crassa

Pseudoceratina

1 reference

Purealidin S and purpuramine J, bromotyrosine alkaloids from the Fijian marine sponge Druinella sp.

Aplysina cavernicola

1 reference

Diving into the Molecular Diversity of Aplysina cavernicola’s Exometabolites: Contribution of Bromo-Spiroisoxazoline Alkaloids

Identifiers

InChI

InChI=1S/C16H19Br2N5O4/c1-26-12-9(17)5-16(13(24)11(12)18)6-10(23-27-16)14(25)20-4-2-3-8-7-21-15(19)22-8/h5,7,13,24H,2-4,6H2,1H3,(H,20,25)(H3,19,21,22)/t13-,16+/m0/s1

1 reference

Aerophobin 2 (English)

9 October 2016

2 references

Aerophobin 2 (English)

9 October 2016

ChEBI release 2020-09-01

2 references

Aerophobin 2 (English)

9 October 2016

https://commonchemistry.cas.org/detail?cas_rn=87075-23-8

9 April 2021

1 reference

aerophobin-2 (English)

9 October 2016

2 references

Aerophobin 2 (English)

matched by identifier from

9 October 2016

ChEBI ID

80953

mapping relation type

2 references

Aerophobin 2 (English)

matched by identifier from

9 October 2016

International Chemical Identifier

InChI

InChI=1S/C16H19Br2N5O4/c1-26-12-9(17)5-16(13(24)11(12)18)6-10(23-27-16)14(25)20-4-2-3-8-7-21-15(19)22-8/h5,7,13,24H,2-4,6H2,1H3,(H,20,25)(H3,19,21,22)/t13-,16+/m0/s1

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

AEROPHOBIN 2 (English)

9 October 2016

1 reference

2 references

matched by identifier from

DSSTOX compound identifier

0 references

1 reference

Aerophobin 2 (English)