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Chemical structure of Neoamygdalin

GC64722

Neoamygdalin

Also known as (2S)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile

Neoamygdalin is a compound identified in the different processed bitter almonds

ChemicalCAS29883-16-7MW457.43FormulaC20H27NO11
CAS number
29883-16-7
Molecular weight
457.43
Formula
C20H27NO11
Solubility
DMSO ： 100 mg/mL (218·61 mM; Need ultrasonic)
InChIKey
XUCIJNAGGSZNQT-UUGBRMIUSA-N
Catalogue number
GC64722
Brand
GLPBIO
Computed properties PubChem CID 441462 · XLogP -2.7 · TPSA 202 Ų · H-bond donors 7
XLogP
-2.7
TPSA
202 Ų
H-bond donors
7
H-bond acceptors
12
Rotatable bonds
7
Heavy atoms
32

SMILES C1=CC=C(C=C1)[C@@H](C#N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O

Computed descriptors from PubChem (CID 441462), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
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