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Hydroxypropyl starch

CAT: 0013-GTR19244546-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19244546-01Size:250 mg
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Description
Hydroxypropyl starch
CAS Number
9049-76-7
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-O-(2,3-Dihydroxy-2-methylpropyl)-4-O-methylhexopyranosyl-(1->4)-(4-O-methylhexopyranosyl-(1->6))hexopyranosyl-(1->5)-2,6-anhydro-1-deoxyheptitol

See also: 2-Hydroxypropyl starch (annotation moved to); Starch, 2-hydroxypropyl ether (annotation moved to) ... View More ...

CAS Number9049-76-7
PubChem CID24847857
IUPAC Name5-[6-[[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxymethyl]-5-[3-(2,3-dihydroxy-2-methylpropoxy)-4-hydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-3,4-dihydroxyoxan-2-yl]oxy-6-(hydroxymethyl)-2-methyloxane-3,4-diol
Molecular FormulaC31H56O22
Molecular Weight780.8
XLogP-8.1
Topological Polar Surface Area335
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count22
Rotatable Bond Count16
Heavy Atom Count53
Formal Charge0
Complexity1090
SMILES
CC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)OC)O)O)OC4C(C(C(C(O4)CO)OC)O)OCC(C)(CO)O)O)O)O)O
InChI
InChI=1S/C31H56O22/c1-11-16(36)17(37)25(14(7-34)48-11)52-29-21(41)19(39)26(15(51-29)8-46-28-20(40)18(38)23(44-3)12(5-32)49-28)53-30-27(47-10-31(2,43)9-35)22(42)24(45-4)13(6-33)50-30/h11-30,32-43H,5-10H2,1-4H3
InChIKey
VYIPQJQYDCRXMM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-O-(2,3-Dihydroxy-2-methylpropyl)-4-O-methylhexopyranosyl-(1->4)-(4-O-methylhexopyranosyl-(1->6))hexopyranosyl-(1->5)-2,6-anhydro-1-deoxyheptitol
CAS: 9049-76-7
CID: 24847857
Formula: C31H56O22
MW: 780.8
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight780.8
XLogP3-8.1
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count22
Rotatable Bond Count16
Exact Mass780.32632341
Monoisotopic Mass780.32632341
Topological Polar Surface Area335 Ų
Heavy Atom Count53
Formal Charge0
Complexity1090
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count21
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes