Chemical Component Summary

Namepentalenolactone F
Synonyms(2R,4a'R,7a'S,9a'R)-6',6'-dimethyl-3'-oxo-1',5',6',7',7a',9a'-hexahydro-3'H-spiro[oxirane-2,4'-pentaleno[1,6a-c]pyran]-9'-carboxylic acid
Identifiers(1~{R},4~{a}~{R},6~{a}~{S},9~{a}~{R})-8,8-dimethyl-2-oxidanylidene-spiro[4~{a},6~{a},7,9-tetrahydro-4~{H}-pentaleno[1,6~{a}-c]pyran-1,2'-oxirane]-5-carboxylic acid
FormulaC15 H18 O5
Molecular Weight278.3
TypeNON-POLYMER
Isomeric SMILESCC1(C[C@H]2C=C([C@H]3[C@]2(C1)[C@@]4(CO4)C(=O)OC3)C(=O)O)C
InChIInChI=1S/C15H18O5/c1-13(2)4-8-3-9(11(16)17)10-5-19-12(18)15(7-20-15)14(8,10)6-13/h3,8,10H,4-7H2,1-2H3,(H,16,17)/t8-,10+,14-,15-/m1/s1
InChIKeyUUDKOVSZNMZKND-BDAURDKOSA-N

Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count4
Bond Count41
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 11065764
ChEBI CHEBI:70809