CHEBI:68591 - eurysterol A sulfonic acid

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ChEBI Name eurysterol A sulfonic acid
ChEBI ID CHEBI:68591
Definition A steroid sulfate that is 5α-cholestane substituted by hydroxy groups at positions 5 and 6, a bridged oxolane at positions 8 and 19 pand a sulfate group at position 3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H46O7S
Net Charge 0
Average Mass 514.71500
Monoisotopic Mass 514.29642
InChI InChI=1S/C27H46O7S/c1-17(2)6-5-7-18(3)20-8-9-21-24(20,4)12-11-22-25-13-10-19(34-35(30,31)32)14-27(25,29)23(28)15-26(21,22)33-16-25/h17-23,28-29H,5-16H2,1-4H3,(H,30,31,32)/t18-,19+,20-,21-,22-,23-,24-,25+,26-,27+/m1/s1
InChIKey MWTQCWZOXMULHF-QZSJCTLHSA-N
SMILES [H][C@@]1(CC[C@]2([H])[C@]1(C)CC[C@]1([H])[C@@]34CC[C@@H](C[C@]3(O)[C@H](O)C[C@@]21OC4)OS(O)(=O)=O)[C@H](C)CCCC(C)C
Roles Classification
Biological Role(s): antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing eurysterol A sulfonic acid (CHEBI:68591) has parent hydride 5α-cholestane (CHEBI:35515)
eurysterol A sulfonic acid (CHEBI:68591) has role antifungal agent (CHEBI:35718)
eurysterol A sulfonic acid (CHEBI:68591) has role antineoplastic agent (CHEBI:35610)
eurysterol A sulfonic acid (CHEBI:68591) has role metabolite (CHEBI:25212)
eurysterol A sulfonic acid (CHEBI:68591) is a 5α-hydroxy steroid (CHEBI:38194)
eurysterol A sulfonic acid (CHEBI:68591) is a 6β-hydroxy steroid (CHEBI:36851)
eurysterol A sulfonic acid (CHEBI:68591) is a bridged compound (CHEBI:35990)
eurysterol A sulfonic acid (CHEBI:68591) is a cyclic ether (CHEBI:37407)
eurysterol A sulfonic acid (CHEBI:68591) is a diol (CHEBI:23824)
eurysterol A sulfonic acid (CHEBI:68591) is a organic heteropentacyclic compound (CHEBI:38164)
eurysterol A sulfonic acid (CHEBI:68591) is a steroid sulfate (CHEBI:16158)
eurysterol A sulfonic acid (CHEBI:68591) is conjugate acid of eurysterol A(1−) (CHEBI:68592)
Incoming eurysterol A(1−) (CHEBI:68592) is conjugate base of eurysterol A sulfonic acid (CHEBI:68591)
IUPAC Name
(3β,5α,6β)-5,6-dihydroxy-8,19-epoxycholestan-3-yl hydrogen sulfate
Synonyms Sources
(3β,5α,6β)-5,6-dihydroxy-8,19-epoxycholestan-3-yl sulfonic acid ChEBI
eurysterol A hydrogen sulfate ChEBI
Last Modified
09 November 2012