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pentalenolactone F

Properties

Image

Occurences in reactions

MNX_ID

MNXM12600

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

formula

C₁₅H₁₇O₅

charge

-1

mass

277.10815

reference

InChIKey

UUDKOVSZNMZKND-BDAURDKOSA-M

InChI

InChI=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)/p-1/t8-,10+,14-,15-/m1/s1

SMILES

CC1(C)C[C@H]2C=C(C(=O)[O-])[C@@H]3COC(=O)[C@]4(CO4)[C@]23C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:70789 chebi:70789	pentalenolactone F (2R,4a'R,7a'S,9a'R)-6',6'-dimethyl-3'-oxo-1',5',6',7',7a',9a'-hexahydrospiro[oxirane-2,4'-pentaleno[1,6a-c]pyran]-9'-carboxylate pentalenolactone F anion pentalenolactone F(1-)
seed.compound:cpd31080 seedM:cpd31080 kegg.compound:C20397 keggC:C20397	Pentalenolactone F
metacyc.compound:CPD-13622 metacycM:CPD-13622 seed.compound:cpd23966 seedM:cpd23966	pentalenolactone F
CHEBI:70809 chebi:70809	pentalenolactone F (2R,4a'R,7a'S,9a'R)-6',6'-dimethyl-3'-oxo-1',5',6',7',7a',9a'-hexahydrospiro[oxirane-2,4'-pentaleno[1,6a-c]pyran]-9'-carboxylic acid
keggC:M_C20397 seedM:M_cpd23966 seedM:M_cpd31080	secondary/obsolete/fantasy identifier