18747-42-7 Purity
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Specification
The molecular formula of serpentine hydrogen tartrate is C25H26N2O9.
Some synonyms for serpentine hydrogen tartrate are 58782-36-8 and 3,4,5,6,16,17-hexadehydro-16-(methoxycarbonyl)-19alpha-methyloxayohimbanium, salt with [R-(R*,R*)]-tartaric acid.
The molecular weight of serpentine hydrogen tartrate is 498.5 g/mol.
The IUPAC name of serpentine hydrogen tartrate is methyl (15R,16S,20S)-16-methyl-17-oxa-3-aza-13-azoniapentacyclo[11.8.0.0 2,10 .0 4,9 .0 15,20 ]henicosa-1(13),2(10),4,6,8,11,18-heptaene-19-carboxylate;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate.
The InChIKey of serpentine hydrogen tartrate is DSBKFQYHOCFEJB-VKSHHDBOSA-N.
The canonical SMILES representation of serpentine hydrogen tartrate is CC1C2C[N+]3=C(CC2C(=CO1)C(=O)OC)C4=C(C=C3)C5=CC=CC=C5N4.C(C(C(=O)[O-])O)(C(=O)O)O.
The CAS number for serpentine hydrogen tartrate is 58782-36-8.
There are 4 hydrogen bond donor counts in serpentine hydrogen tartrate.
The topological polar surface area of serpentine hydrogen tartrate is 173 Ų.
There are 5 defined atom stereocenter counts in serpentine hydrogen tartrate.