CHEBI:66173 - sarasinoside J

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ChEBI Name sarasinoside J
ChEBI ID CHEBI:66173
Definition A triterpenoid saponin isolated from the sponge Melophlus sarasinorum and has been shown to exhibit antimicrobial activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C62H102N2O27
Net Charge 0
Average Mass 1307.47050
Monoisotopic Mass 1306.66700
InChI InChI=1S/C62H102N2O27/c1-25(18-28(70)19-59(4,5)81)30-11-12-31-29-10-13-38-60(6,7)39(15-17-62(38,9)32(29)14-16-61(30,31)8)89-58-52(46(75)37(24-83-58)88-54-40(63-26(2)68)47(76)42(71)33(20-65)84-54)90-55-41(64-27(3)69)48(77)45(74)36(87-55)23-82-57-53(50(79)44(73)35(22-67)86-57)91-56-51(80)49(78)43(72)34(21-66)85-56/h25,30-31,33-58,65-67,71-81H,10-24H2,1-9H3,(H,63,68)(H,64,69)/t25-,30-,31+,33-,34-,35-,36-,37-,38+,39+,40-,41-,42+,43-,44-,45-,46+,47-,48-,49+,50+,51-,52-,53-,54+,55+,56+,57-,58+,61-,62-/m1/s1
InChIKey IFLLFJMUKCVLRY-KMTMZHINSA-N
SMILES [H][C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1OC[C@H]1O[C@@]([H])(O[C@@H]2[C@@H](O)[C@@H](CO[C@@]2([H])O[C@H]2CC[C@]3(C)C4=C(CC[C@@]3([H])C2(C)C)[C@]2([H])CC[C@]([H])([C@H](C)CC(=O)CC(C)(C)O)[C@@]2(C)CC4)O[C@]2([H])O[C@H](CO)[C@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H](NC(C)=O)[C@@H](O)[C@@H]1O
Metabolite of Species Details
Melophlus sarasinorum (WORMS:169852) See: PubMed
Roles Classification
Biological Role(s): marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sarasinoside J (CHEBI:66173) has role antimicrobial agent (CHEBI:33281)
sarasinoside J (CHEBI:66173) has role marine metabolite (CHEBI:76507)
sarasinoside J (CHEBI:66173) is a amino pentasaccharide (CHEBI:59268)
sarasinoside J (CHEBI:66173) is a tetracyclic triterpenoid (CHEBI:26893)
sarasinoside J (CHEBI:66173) is a triterpenoid saponin (CHEBI:61778)
IUPAC Name
(3β,5α)-25-hydroxy-4,4-dimethyl-23-oxocholest-8-en-3-yl 2-(acetylamino)-2-deoxy-β-D-galactopyranosyl-(1→4)-[β-D-glucopyranosyl-(1→2)-β-D-glucopyranosyl-(1→6)-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1→2)]-β-D-xylopyranoside
Synonym Source
3β-O-[β-D-glucopyranosyl(1→2)-β-D-glucopyranosyl( 1→6)-β-D-N-acetyl-2-amino-glucopyranosyl(1→2)- β-D-xylopyranosyl(4→1)-β-D-N-acetyl-2-aminogalactopyranosyl]- 25-hydroxy-30-norlanosta-8(9)-en-23-one ChEBI
Registry Number Type Source
15775202 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
16124767 PubMed citation Europe PMC
Last Modified
20 January 2014