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Sodium polypectate

Catalog Number
ACM9049370
Product Name
Sodium polypectate
CAS
9049-37-0
Category
Polysaccharide
Synonyms
pecticacid,sodiumsalt;SODIUM POLYPECTATE;POLYANHYDROGALACTURONIC ACID SODIUM SALT;POLYGALACTURONIC ACID SODIUM SALT;polygalacturonic acid, sodium salt from citrus fr;POLYGALACTURONIC ACID,SODIUM SALT FROM C ITRUS FRUIT;POLYGALACTURONIC ACID SODIUN;Polyanhydrogalacturonicacid,Sodiumpolypectate
IUPAC Name
sodium;(2S,3R,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-2-carboxylato-6-[(2S,3R,4R,5R,6S)-2-carboxylato-4,5,6-trihydroxyoxan-3-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
Molecular Weight
566.4g/mol
Molecular Formula
C18H23NaO19-2
Canonical SMILES
C1(C(C(OC(C1O)OC2C(C(C(OC2C(=O)[O-])OC3C(C(C(OC3C(=O)[O-])O)O)O)O)O)C(=O)[O-])O)O.[Na+]
InChI
InChI=1S/C18H26O19.Na/c19-1-2(20)10(13(26)27)36-17(6(1)24)35-9-4(22)7(25)18(37-12(9)15(30)31)34-8-3(21)5(23)16(32)33-11(8)14(28)29;/h1-12,16-25,32H,(H,26,27)(H,28,29)(H,30,31);/q;+1/p-3/t1-,2+,3+,4+,5+,6+,7+,8+,9+,10-,11-,12-,16-,17-,18-;/m0./s1
InChI Key
NUCACHWVTZGFJN-PYSZDIKSSA-K
Complexity
836
Covalently-Bonded Unit Count
2
Exact Mass
566.073123g/mol
Formal Charge
-2
Heavy Atom Count
38
MeSH Entry Terms
calcium pectate;calcium polygalacturonate;galacturonan;homogalacturonan;pectate;pectic acid;polygalacturonic acid;polygalacturonic acid homopolymer;polygalacturonic acid, aluminum salt;polygalacturonic acid, calcium salt;polygalacturonic acid, homopolymer (D)-isomer;polygalacturonic acid, homopolymer sodium salt;polygalacturonic acid, sulfated;sodium pectate;sodium polygalacturonate
Monoisotopic Mass
566.073123g/mol
Rotatable Bond Count
4
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