OntologiesslmclassesCHEBI:195282   
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xyloketal BImported
http://purl.obolibrary.org/obo/CHEBI_195282

A xyloketal with formula C20H26O5. It was initially isolated from the mangrove fungus Xylaria sp. from the South China sea coast.

Defined bychebi
Exact Synonyms
(3R,3aR,7aR,10R,10aR,12aR)-3,7a,10,12a-tetramethyl-2,3,3a,9,10,10a,11,12a-octahydro-4H,7aH-furo[2,3-b]furo[3',2':5,6]pyrano[2,3-f]chromen-5-ol
Related Synonyms
(+)-xyloketal B
(3R,3aR,7aR,10R,10aR,12aR)-3,7a,10,12a-tetramethyl-2,3,3a,9,10,10a,11,12a-octahydro-4H,7aH-difuro[3,2-e:3,2-e']benzo[1,2-b:5,6-b']dipyran-5-ol
class Information
charge

0

formula

C20H26O5

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C20H26O5/c1-10-9-23-20(4)14(10)5-12-16(21)7-17-13(18(12)25-20)6-15-11(2)8-22-19(15,3)24-17/h7,10-11,14-15,21H,5-6,8-9H2,1-4H3/t10-,11-,14+,15+,19+,20+/m0/s1

inchikey

CCNANHBVUNZCKA-FCOFOHSNSA-N

in_subset

3_STAR

mass

346.423

monoisotopicmass

346.17802

smiles

[H][C@]12CC3=C(O[C@@]1(C)OC[C@@H]2C)C1=C(O[C@@]2(C)OC[C@H](C)[C@@]2([H])C1)C=C3O

class Relations