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Chemical structure of Arjunglucoside I

GC76417

Arjunglucoside I

Also known as [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1S,4aR,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

Arjunglucoside I, a natural compound, possesses antimicrobial activity with a MIC of 1·9 μg/mL

ChemicalCAS62319-70-4MW666.84FormulaC36H58O11
CAS number
62319-70-4
Molecular weight
666.84
Formula
C36H58O11
Solubility
DMSO： 50 mg/mL (74·98 mM; Need ultrasonic)
InChIKey
CMZFNIMQBCBHEX-APNSOIJXSA-N
Catalogue number
GC76417
Brand
GLPBIO
Computed properties PubChem CID 14658050 · XLogP 2.7 · TPSA 197 Ų · H-bond donors 8
XLogP
2.7
TPSA
197 Ų
H-bond donors
8
H-bond acceptors
11
Rotatable bonds
5
Heavy atoms
47

SMILES C[C@@]12CC[C@@H]3[C@@]([C@H]1CC=C4[C@]2(CC[C@@]5([C@H]4[C@@H](C(CC5)(C)C)O)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)(C[C@H]([C@@H]([C@@]3(C)CO)O)O)C

Computed descriptors from PubChem (CID 14658050), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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