CHEBI:65996 - halistanol sulfate F

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ChEBI Name halistanol sulfate F
ChEBI ID CHEBI:65996
Definition An organic sodium salt that is the trisodium salt of halistanol sulfonic acid F. Isolated from the marine sponge Pseudaxinyssa digitata, it exhibits anti-HIV activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C30H51Na3O12S3
Net Charge 0
Average Mass 768.88300
Monoisotopic Mass 768.22357
InChI InChI=1S/C30H54O12S3.3Na/c1-8-28(4,5)19(3)10-9-18(2)21-11-12-22-20-15-25(40-43(31,32)33)24-16-26(41-44(34,35)36)27(42-45(37,38)39)17-30(24,7)23(20)13-14-29(21,22)6;;;/h18-27H,8-17H2,1-7H3,(H,31,32,33)(H,34,35,36)(H,37,38,39);;;/q;3*+1/p-3/t18-,19?,20+,21-,22+,23+,24-,25+,26+,27+,29-,30-;;;/m1.../s1
InChIKey YMPFBLQGUNEWQH-FLZIPAQVSA-K
SMILES [Na+].[Na+].[Na+].[H][C@@]1(CC[C@@]2([H])[C@]3([H])C[C@H](OS([O-])(=O)=O)[C@@]4([H])C[C@H](OS([O-])(=O)=O)[C@H](C[C@]4(C)[C@@]3([H])CC[C@]12C)OS([O-])(=O)=O)[C@H](C)CCC(C)C(C)(C)CC
Metabolite of Species Details
Pseudaxinyssa digitata (WORMS:132674) See: PubMed
Roles Classification
Biological Role(s): anti-HIV-2 agent
An anti-HIV agent that destroys or inhibits the replication of HIV-2, the less infective and less virulent of the two types of HIV virus.
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.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing halistanol sulfate F (CHEBI:65996) has part halistanol sulfate F(3−) (CHEBI:72476)
halistanol sulfate F (CHEBI:65996) has role anti-HIV-1 agent (CHEBI:64947)
halistanol sulfate F (CHEBI:65996) has role anti-HIV-2 agent (CHEBI:64949)
halistanol sulfate F (CHEBI:65996) has role metabolite (CHEBI:25212)
halistanol sulfate F (CHEBI:65996) is a organic sodium salt (CHEBI:38700)
Registry Number Type Source
12013883 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
8158159 PubMed citation Europe PMC
Last Modified
18 February 2013