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CHEBI:86403 - adenosylhopane

ChEBI IDCHEBI:86403
ChEBI Nameadenosylhopane
Stars
DefinitionA bacterial hopanoid obtained by addition of an adenosyl group across the double bond of hopene.
Last Modified21 July 2015
Submittergemma
DownloadsMolfile
FormulaC40H63N5O3
Net Charge0
Average Mass661.976
Monoisotopic Mass661.49309
SMILES[H][C@]12CC[C@@]3([H])[C@@](C)(CC[C@@]4([H])C(C)(C)CCC[C@]34C)[C@]1(C)CC[C@@]1([H])C(C(C)CC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)CC[C@]21C
InChIInChI=1S/C40H63N5O3/c1-23(9-10-26-31(46)32(47)35(48-26)45-22-44-30-33(41)42-21-43-34(30)45)24-13-18-37(4)25(24)14-19-39(6)28(37)11-12-29-38(5)17-8-16-36(2,3)27(38)15-20-40(29,39)7/h21-29,31-32,35,46-47H,8-20H2,1-7H3,(H2,41,42,43)/t23?,24?,25-,26+,27-,28+,29+,31+,32+,35+,37-,38-,39+,40+/m0/s1
InChIKeyYCIUCIBXUZOYMY-WCEMGWLASA-N
Species of MetaboliteComponentSourceComments
Hymenobacter roseus (ncbitaxon:1480696) - PubMed (25242537)
Methylobacterium organophilum (ncbitaxon:410) - PubMed (26032177)
Rhodomicrobium udaipurense JA643 (ncbitaxon:858455) - PubMed (25117430) Strain: JA643T
Rhodopseudomonas palustris TIE-1 (ncbitaxon:395960) - PubMed (22221333) Strain: TIE-1
Salinimicrobium sediminis (ncbitaxon:1343891) - PubMed (24425818)
Streptomyces coelicolor A3(2) (ncbitaxon:100226) - PubMed (25155017)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
adenosylhopane (CHEBI:86403) has role bacterial metabolite (CHEBI:76969)
adenosylhopane (CHEBI:86403) is a adenosines (CHEBI:22260)
adenosylhopane (CHEBI:86403) is a hopanoid (CHEBI:51963)
Synonyms  Source
30-(5'-Adenosyl)hopaneChemIDplus
adenosylhopeneSUBMITTER
Manual XrefsDatabases
CPD-14522MetaCyc
LMPR04000012LIPID MAPS
Registry NumbersSources
CAS:97885-00-2ChemIDplus
Citations