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Chemical structure of Militarine

GC60247

Militarine

Also known as bis[[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl] (2R)-2-hydroxy-2-(2-methylpropyl)butanedioate

Militarine, a glycosidic compound isolated from Bletilla striata, exhibits plant growth-inhibitory activity

ChemicalCAS58139-23-4MW726.72FormulaC34H46O17
CAS number
58139-23-4
Molecular weight
726.72
Formula
C34H46O17
Solubility
DMSO ： 100 mg/mL (137·60 mM; Need ultrasonic); H2O ： ≥ 50 mg/mL (68·80 mM)
InChIKey
GQNUDXCKVPLQBI-KIQVUASESA-N
Catalogue number
GC60247
Brand
GLPBIO
Computed properties PubChem CID 171638 · XLogP -0.5 · TPSA 272 Ų · H-bond donors 9
XLogP
-0.5
TPSA
272 Ų
H-bond donors
9
H-bond acceptors
17
Rotatable bonds
17
Heavy atoms
51

SMILES CC(C)C[C@@](CC(=O)OCC1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)(C(=O)OCC3=CC=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O

Computed descriptors from PubChem (CID 171638), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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