Chemical Compound

Tubeimoside

CAS Registry Number 102040-03-9
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Tubeimoside chemical structure
Primary Record

Tubeimoside

In stock
1,604 g
Purity
98.2 %
CAS
102040-03-9

Compound Identifiers & Properties

CAS
102040-03-9
PubChem CID
73362
SMILES
C[C@H]1[C@H]2[C@H]([C@H]([C@@H](O1)O[C@@H]3[C@H]([C@@H](CO[C@H]3OC(=O)[C@@]45CC[C@@]6(C(=CC[C@]7([C@]6(CC[C@H]8[C@@]7(C[C@@H]([C@@H]([C@@]8(C)CO)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C(=O)C[C@](CC(=O)O2)(C)O)O)O)O)O)C)C)C)[C@@]4(CC(CC5)(C)C)C)C)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O
Canonical SMILES
C[C@@H]1O[C@H]2O[C@H]3[C@@H](OC[C@@H](O)[C@@H]3O)OC(=O)[C@]34CCC(C)(C)C[C@@]3(C)C3=CC[C@@]5(C)[C@@](C)(CC[C@@H]6[C@](C)(CO)[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O[C@@H]7O[C@@H](C(=O)C[C@](C)(O)CC(=O)O[C@@H]1[C@@H](O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O)[C@H]2O)[C@H](O)[C@H](O)[C@H]7O)[C@@H](O)C[C@@]65C)[C@]3(C)CC4

Names & Synonyms

  • Tubeimoside
  • Tubeimoside I
  • Tubeimoside-1
  • TBMS1 saponin
  • Triterpenoid saponin tub
  • TUBEIMOSIDE A
  • AC1L2JQD
  • AC1Q6OKW
  • RefChem:1100549
  • SCHEMBL31156720
  • KST-1A0366
  • CID73362
  • AR-1A1663
  • 102040-03-9
  • (1s,4s,7r,8s,9r,11s,13s,14s,18s,21r,22r,23s,24r,25r,27r,28s,29s,30r,32r,34r,35s,37s,38s,41r,42r,46s,53s,54r,56s,57r)-7,8,18,22,23,24,28,29,35,57-decahydroxy-30,54-bis(hydroxymethyl)-13,18,37,41,42,46,48,48,53,54-decamethyl-56-{[(2s,3r,4s,5r)-3,4,5-trihydroxytetrahydro-2h-pyran-2-yl]oxy}-3,5,10,12,15,26,31,33,55-nonaoxadecacyclo[39.9.3.211,14.121,25.134,38.01,46.04,9.027,32.037,42.045,53]heptapentacont-44-ene-2,16,20-trione(non-preferred name)
  • (1S,4S,7R,8S,9R,11S,13S,14S,18S,21R,22R,23S,24R,25R,27R,28S,29S,30R,32R,34R,35S,37S,38S,41R,42R,46S,53S,54R,56S,57R)-7,8,18,22,23,24,28,29,35,57-decahydroxy-30,54-bis(hydroxymethyl)-13,18,37,41,42,46,48,48,53,54-decamethyl-56-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-3,5,10,12,15,26,31,33,55-nonaoxadecacyclo[39.9.3.211,14.121,25.134,38.01,46.04,9.027,32.037,42.045,53]heptapentacont-44-ene-2,16,20-trione
  • 102433-53-4
  • Tub
  • (1S,4S,7R,8S,9R,11S,13S,14S,18S,21R,22R,23S,24R,25R,27R,28S,29S,30R,32R,34R,35S,37S,38S,41R,42R,46S,53S,54R,56S,57R)-7,8,18,22,23,24,28,29,35,57-decahydroxy-30,54-bis(hydroxymethyl)-13,18,37,41,42,46,48,48,53,54-decamethyl-56-((2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl)oxy-3,5,10,12,15,26,31,33,55-nonaoxadecacyclo(39.9.3.211,14.121,25.134,38.01,46.04,9.027,32.037,42.045,53)heptapentacont-44-ene-2,16,20-trione
  • decahydroxy-bis(hydroxymethyl)-decamethyl-[(2S,3R,4S,5R)-3,4,5-trihydroxytetrahydropyran-2-yl]oxy-[?]trione
  • Olean-12-en-28-oic acid, 3-[[2-O-[4-O-[(3S)-4-carboxy-3-hydroxy-3-methyl-1-oxobutyl]-.alpha.-L-arabinopyranosyl]-.beta.-D-glucopyranosyl]oxy]-2,23-dihydroxy-, 28-(O-.beta.-D-xylopyranosyl-(1.fwdarw.3)-O-6-deoxy-.alpha.-L-mannopyranosyl-(1.fwdarw.2)-.alpha.-L-arabinopyranosyl) ester, intramol.ester, (2.beta.,3.beta.,4.alpha.)-