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batzelladine A |
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CHEBI:65466 |
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A carboxylic ester obtained by the formal condensation of (2aS,3S,4R,7R,8aS)-4-methyl-7-nonyl-2,2a,3,4,6,7,8,8a-octahydro-1H-5,6,8b-triazaacenaphthylene-3-carboxylic acid with the hydroxy group of 4-carbamimidamidobutyl (3R)-3-(9-hydroxynonyl)-1-imino-1,2,3,5,6,7-hexahydropyrrolo[1,2-c]pyrimidine-4-carboxylate. Isolated from a bright red Caribbean sponge, Batzella, it has potential anti-HIV activity. |
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![](images/goldenstar.gif) ![](images/goldenstar.gif)
This entity has been manually annotated by the ChEBI Team.
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Molfile
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SDF
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InChI=1S/C42H73N9O4/c1- 3- 4- 5- 6- 8- 11- 14- 20- 31- 29- 32- 23- 24- 35- 36(30(2) 47- 42(48- 31) 51(32) 35) 38(52) 54- 27- 17- 13- 10- 7- 9- 12- 15- 21- 33- 37(34- 22- 19- 26- 50(34) 41(45) 49- 33) 39(53) 55- 28- 18- 16- 25- 46- 40(43) 44/h30- 33,35- 36H,3- 29H2,1- 2H3,(H2,45,49) (H,47,48) (H4,43,44,46) /t30- ,31- ,32+,33- ,35+,36+/m1/s1 |
WZGMBJKFYVONHF-LJQXCJTBSA-N |
[H] [C@] 12CC[C@@] 3([H] ) [C@H] ([C@@H] (C) N=C(N[C@H] (CCCCCCCCC) C1) N23) C(=O) OCCCCCCCCC[C@H] 1NC(=N) N2CCCC2=C1C(=O) OCCCCNC(N) =N |
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metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
anti-HIV-1 agent
An anti-HIV agent that destroys or inhibits the replication of HIV-1, the more infective and more virulent of the two types of HIV virus.
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View more via ChEBI Ontology
9- {(3R)- 4- [(4- carbamimidamidobutoxy)carbonyl]- 1- imino- 1,2,3,5,6,7- hexahydropyrrolo[1,2- c]pyrimidin- 3- yl}nonyl (2aS,3S,4R,7R,8aS)- 4- methyl- 7- nonyl- 2,2a,3,4,6,7,8,8a- octahydro- 1H- 5,6,8b- triazaacenaphthylene- 3- carboxylate
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147664-18-4
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CAS Registry Number
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ChemIDplus
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11388864
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PubMed citation
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Europe PMC
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