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AG00I9WI

55466-05-2 | Jujuboside B

55466-05-2
AG00I9WI
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CAS Number 55466-05-2
Catalog Number AG00I9WI(AGN-PC-0SJ3S0)
Chemical Name Jujuboside B
IUPAC Name (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5S)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
InChI InChI=1S/C52H84O21/c1-22(2)15-24-16-50(8,63)42-25-9-10-30-48(6)13-12-31(47(4,5)29(48)11-14-49(30,7)51(25)20-52(42,73-24)66-21-51)69-45-41(72-44-38(62)35(59)32(56)23(3)67-44)39(27(55)19-65-45)70-46-40(36(60)34(58)28(17-53)68-46)71-43-37(61)33(57)26(54)18-64-43/h15,23-46,53-63H,9-14,16-21H2,1-8H3/t23-,24-,25+,26+,27-,28+,29-,30+,31-,32-,33-,34+,35+,36-,37+,38+,39-,40+,41+,42-,43-,44-,45-,46-,48-,49+,50-,51-,52-/m0/s1
InChI Key OAVAUZCEOWCYCC-QEOGCQCLSA-N
MDL Number MFCD03427710
Molecular Formula C52H84O21
Molecular Weight 1045.2108
SMILES O[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1O)CO)O[C@@H]1[C@H]([C@@H](OC[C@@H]1O)O[C@@H]1C([C@@H]2CC[C@@]3([C@H](CC[C@@H]4[C@@H]5[C@@]6(OC[C@]34C6)O[C@H](C[C@]5(C)O)C=C(C)C)[C@]2(CC1)C)C)(C)C)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O
Synonyms
jujuboside B, Jujuboside B, 55466-05-2, CHEMBL3109480, Jujuboside B, >=98% (HPLC), C52H84O21, AKOS025311225, ACN-035217, O902, C17832, 466J052, C-23598, Q-100637, Jujuboside, JujubosideB,

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    CERTIFICATE OF ANALYSIS
    Chemical Name: Batch Number:
    Chemical Structure: CAS Registry No:
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    Test: Result:
    Conclusion: The above product meets the specifications of Angene.
    Analyst:Chase
    Date:
    Reviewed by:Jessie
    Date:
    Angene International Limited