Products 32449-98-2

CAS 32449-98-2 appears in our catalog under these names: khasianine, 98%, 98%, Khasianine, >95% (HPLC), Khasianine, Khasianine/ 99.26% (existing batch purity), Khasianine (Standard). Offered by: Chemat, TRC, GLPBio, TargetMol, Biosynth. Available pack sizes: 10mg, 25mg, 2,5mg, 5mg, 20mg, 1mg, 50mg, 100mg.

khasianine, 98%, 98%
Chemat
  • size: 10mg, 25mg
  • Variants: 2
from 558.80
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Khasianine, >95% (HPLC)
TRC
  • size: 2,5mg, 25mg, 5mg
  • Variants: 3
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Khasianine
GLPBio, Biosynth
  • size: 20mg, 50mg, 25mg, 100mg
  • Variants: 4
from 3442.78
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Khasianine/ 99.26% (existing batch purity)
TargetMol
  • size: 1mg, 5mg, 10mg, 25mg
  • Variants: 7
from 684.65
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Khasianine (Standard)
MedChemExpress
  • size: Get quote
  • Variants: 1
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Khasianine, 99.11%
MedChemExpress
  • size: 10 mg, 1 mg, 5 mg
  • Variants: 3
from 310.40
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Structural formula: {0} (CAS {1})

(2S,3R,4R,5R,6S)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol (CAS 32449-98-2) is a chemical compound with the molecular formula C39H63NO11 and a molecular weight of 721.9 g/mol. IUPAC name: (2S,3R,4R,5R,6S)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol. InChIKey: KRQDMAXNTWLTDZ-HCTICQNOSA-N.

Identity
Molecular formulaC39H63NO11
Molecular weight721.9 g/mol
IUPAC name(2S,3R,4R,5R,6S)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
InChIKeyKRQDMAXNTWLTDZ-HCTICQNOSA-N
SMILESC[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)O)O)C)C)C)NC1

Computed by PubChem (NCBI)

Synonyms: Khasianine, L-Rhamnopyranosyl-14-D-glucopyranose solasodine, beta2-Solamargine, |A2-Solamargine, Khasianine (Standard), orb1303273, orb3140194
Isomers (same molecular formula)
(2S,3R,4S,5S,6R)-2-[(2R,3S,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-[[(1S,2S,7S,10R,11S,14S,15R,16S,17R,20S,23S)-10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.02,11.05,10.015,23.017,22]tetracos-4-en-7-yl]oxy]oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol C39H63NO11
(2R,3R,4S,5S,6R)-6-[[(2S,3S,4R,5R,6R)-3,5-dihydroxy-2-methyl-6-[(1S,2S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-piperidine]-16-yl]oxyoxan-4-yl]oxymethyl]oxane-2,3,4,5-tetrol C39H63NO11