(2S,3S,4S,5R,6R)-6-(((2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4-carboxy-8a-((((2S,3R,4R,5R,6S)-4,5-dihydroxy-3-(((2S,3R,4S,5S,6S)-3-hydroxy-6-methyl-4,5-bis(((2R,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-methyltetrahydro-2H-pyran-2-yl)oxy)carbonyl)-2-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid

Catalog No. :
ACFHIN284
CAS No. :
1623405-29-7
Molecular Formula :
C58H90O28
Molecular Weight :
1235.33

IUPAC Name:(2S,3S,4S,5R,6R)-6-(((2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4-carboxy-8a-((((2S,3R,4R,5R,6S)-4,5-dihydroxy-3-(((2S,3R,4S,5S,6S)-3-hydroxy-6-methyl-4,5-bis(((2R,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-methyltetrahydro-2H-pyran-2-yl)oxy)carbonyl)-2-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid

(2S,3S,4S,5R,6R)-6-(((2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4-carboxy-8a-((((2S,3R,4R,5R,6S)-4,5-dihydroxy-3-(((2S,3R,4S,5S,6S)-3-hydroxy-6-methyl-4,5-bis(((2R,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-methyltetrahydro-2H-pyran-2-yl)oxy)carbonyl)-2-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid structure diagram
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10mg95%$828.00Login to see priceInquiryInquiry

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Product Information

Product Name(2S,3S,4S,5R,6R)-6-(((2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4-carboxy-8a-((((2S,3R,4R,5R,6S)-4,5-dihydroxy-3-(((2S,3R,4S,5S,6S)-3-hydroxy-6-methyl-4,5-bis(((2R,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-methyltetrahydro-2H-pyran-2-yl)oxy)carbonyl)-2-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
IUPAC Name(2S,3S,4S,5R,6R)-6-(((2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4-carboxy-8a-((((2S,3R,4R,5R,6S)-4,5-dihydroxy-3-(((2S,3R,4S,5S,6S)-3-hydroxy-6-methyl-4,5-bis(((2R,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-methyltetrahydro-2H-pyran-2-yl)oxy)carbonyl)-2-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
MDL No.-
Molecular FormulaC58H90O28
Molecular Weight1235.33
SMILESC[C@@H]1O[C@@H](OC(=O)[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(C(=O)O)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)[C@H](O[C@@H]2O[C@@H](C)[C@H](O[C@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O[C@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O)[C@H](O)[C@H]1O
InChI KeyXBTOCVCSOCBSJV-ZKHXJIHHSA-N
SynonymCelosin J;Olean-12-ene-23,28-dioic acid, 3-(β-D-glucopyranuronosyloxy)-2-hydroxy-, 28-(O-β-L-arabinopyranosyl-1→3-[O-β-D-xylopyranosyl-(1→4)]-O-6-deoxy-α-L-mannopyranosyl-(1→2)-6-deoxy-β-D-galactopyranosyl) ester, (2β,3β,4α)-
CAS No.1623405-29-7

Synthetic Route by SureRoute

1. ACFHIN284 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACFHIN284 route product structure diagram
    ACFHIN2841623405-29-7
Inquiry

2. ACFHIN284 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACFHIN284 route product structure diagram
    ACFHIN2841623405-29-7
Inquiry

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