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Home > Encyclopedia > (1S)-1α-(β-D-Glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-5-oxocyclopenta[c]pyran-4,7α-dicarboxylic acid dimethyl ester

(1S)-1α-(β-D-Glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-5-oxocyclopenta[c]pyran-4,7α-dicarboxylic acid dimethyl ester

(1S)-1α-(β-D-Glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-5-oxocyclopenta[c]pyran-4,7α-dicarboxylic acid dimethyl ester structure

(1S)-1α-(β-D-Glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-5-oxocyclopenta[c]pyran-4,7α-dicarboxylic acid dimethyl ester 

structure
  • CAS No:

    71035-06-8

  • Formula:

    C18H24O12

  • Chemical Name:

    (1S)-1α-(β-D-Glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-5-oxocyclopenta[c]pyran-4,7α-dicarboxylic acid dimethyl ester

  • Synonyms:

    (1S)-1α-(β-D-Glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-5-oxocyclopenta[c]pyran-4,7α-dicarboxylic acid dimethyl ester;Griselinoside;Griseliside

  • Categories:

    Natural Products  >  Iridoid Derivatives

(1S)-1α-(β-D-Glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-5-oxocyclopenta[c]pyran-4,7α-dicarboxylic acid dimethyl ester Basic Attributes

432.4 g/mol

432.12677620 g/mol

Characteristics

178 Ų

Computed Properties

Molecular Weight:432.4
XLogP3:-2.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:7
Exact Mass:432.12677620
Monoisotopic Mass:432.12677620
Topological Polar Surface Area:178
Heavy Atom Count:30
Complexity:720
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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