Betaine D-galacturonate

Name: Betaine D-galacturonate
SKU: ACM93778406
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CAS

93778-40-6

Catalog Number

ACM93778406

Category

Other Products

Molecular Weight

311.285740 [g/mol]

Molecular Formula

C₆H₉O₇.C₅H₁₂NO₂

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Specification

Synonyms

Betaine D-galacturonate, CID83882, EINECS 298-176-9, D-Galacturonic acid, ion(1-), 1-carboxy-N,N,N-trimethylmethanaminium, 93778-40-6

IUPAC Name

carboxymethyl(trimethyl)azanium; (2S,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoate

Canonical SMILES

C[N+](C)(C)CC(=O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O

InChI Key

NTRGSJJAAMSXHU-RMTXHFLUSA-N

EC Number

298-176-9

Exact Mass

311.12200

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of Betaine D-galacturonate?

The molecular formula of Betaine D-galacturonate is C11H21NO9.

What is the molecular weight of Betaine D-galacturonate?

The molecular weight of Betaine D-galacturonate is 311.29 g/mol.

What are some synonyms for Betaine D-galacturonate?

Some synonyms for Betaine D-galacturonate are 93778-40-6, DTXSID20239633, EINECS 298-176-9, and D-Galacturonic acid, ion(1-), 1-carboxy-N,N,N-trimethylmethanaminium.

What is the IUPAC name of Betaine D-galacturonate?

The IUPAC name of Betaine D-galacturonate is carboxymethyl(trimethyl)azanium;(2S,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoate.

What is the InChI of Betaine D-galacturonate?

The InChI of Betaine D-galacturonate is InChI=1S/C6H10O7.C5H11NO2/c7-1-2(8)3(9)4(10)5(11)6(12)13;1-6(2,3)4-5(7)8/h1-5,8-11H,(H,12,13);4H2,1-3H3/t2-,3+,4+,5-;/m0.

What is the InChIKey of Betaine D-galacturonate?

The InChIKey of Betaine D-galacturonate is NTRGSJJAAMSXHU-RMTXHFLUSA-N.

What is the canonical SMILES of Betaine D-galacturonate?

The canonical SMILES of Betaine D-galacturonate is C[N+](C)(C)CC(=O)O.C(=O)C(C(C(C(C(=O)[O-])O)O)O)O.

What is the isomeric SMILES of Betaine D-galacturonate?

The isomeric SMILES of Betaine D-galacturonate is C[N+](C)(C)CC(=O)O.C(=O)[C@@H]([C@H]([C@H]([C@@H](C(=O)[O-])O)O)O)O.

What is the CAS number of Betaine D-galacturonate?

The CAS number of Betaine D-galacturonate is 93778-40-6.

Is Betaine D-galacturonate a canonicalized compound?

Yes, Betaine D-galacturonate is a canonicalized compound.

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