Products 60077-46-5

CAS 60077-46-5 appears in our catalog under these names: Secologanic acid, Secologanic Acid, Secologanic acid/ 98.99% (existing batch purity), Secologanic acid, 98.02%. Offered by: GLPBio, Chemat Brand, TargetMol, Biosynth, Chemat. Available pack sizes: 5mg, on request, 1mg, 10mg, 25mg, 50mg, 100mg, 5 mg.

Secologanic acid
GLPBio
  • size: 5mg, 1mg, 10mg
  • Variants: 3
from 1046.37
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Secologanic Acid
Chemat Brand, Biosynth, Chemat
  • size: on request, 50mg, 25mg, 100mg
  • Variants: 5
from 1115.60
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Secologanic acid/ 98.99% (existing batch purity)
TargetMol
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 4
from 956.89
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Secologanic acid, 98.02%
MedChemExpress
  • size: 5 mg, 1 mg
  • Variants: 2
from 723.72
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Structural formula: {0} (CAS {1})

(4aS,5R,6S)-5-ethenyl-3-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one (CAS 60077-46-5) is a chemical compound with the molecular formula C16H22O10 and a molecular weight of 374.34 g/mol. IUPAC name: (4aS,5R,6S)-5-ethenyl-3-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one. InChIKey: LCTYGGXMQYUYHL-UEMOXOMHSA-N.

Identity
Molecular formulaC16H22O10
Molecular weight374.34 g/mol
IUPAC name(4aS,5R,6S)-5-ethenyl-3-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one
InChIKeyLCTYGGXMQYUYHL-UEMOXOMHSA-N
SMILESC=C[C@@H]1[C@@H]2CC(OC(=O)C2=CO[C@H]1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Secologanic acid, orb1297607
Isomers (same molecular formula)
methyl (2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-prop-2-enoxyoxane-2-carboxylate C16H22O10
(1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid C16H22O10