Chemical structure of CAS 2319668-87-4

(4aS,6R,6aR,6aS,6bR,8aR,9R,10S,12aS,13R,14bS)-10-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6,13-dihydroxy-4a,9-bis(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-3,4,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picen-5-one

CAS No.2319668-87-4
MDL No.N/A
MFC42H68O15
MW813.00
InChI KeyONZYNENDGFEXPD-NKRJZQNQSA-N
CUSTOM SYNTHESIS

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Product Information

CAS No.2319668-87-4
Product Name(4aS,6R,6aR,6aS,6bR,8aR,9R,10S,12aS,13R,14bS)-10-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6,13-dihydroxy-4a,9-bis(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-3,4,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picen-5-one
Heavy Atom Count57Rotatable Bond Count7
Atom Stereo Count21Bond Stereo Count0
HBA15HBD10
TPSA256.290 ŲCharge0
Exact Mass812.45582Complexity1556.24
pKa11.175XLogP-0.090