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AG0021SB

1802-12-6 | Olean-12-ene-28,29-dioic acid, 2,3,23-trihydroxy-, 29-methyl ester, (2β,3β,4α,20β)-

Chemical structure of Olean-12-ene-28,29-dioic acid, 2,3,23-trihydroxy-, 29-methyl ester, (2β,3β,4α,20β)-, CAS 1802-12-6
AG0021SB
sdsSDS
sdsCOA

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CAS Number 1802-12-6
Catalog Number AG0021SB(AGN-PC-0QBRQU)
Chemical Name Olean-12-ene-28,29-dioic acid, 2,3,23-trihydroxy-, 29-methyl ester, (2β,3β,4α,20β)-
IUPAC Name (2S,4aR,6aR,6aS,6bR,8aR,9R,10R,11S,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2-methoxycarbonyl-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
InChI InChI=1S/C31H48O7/c1-26(25(37)38-6)11-13-31(24(35)36)14-12-29(4)18(19(31)15-26)7-8-22-27(2)16-20(33)23(34)28(3,17-32)21(27)9-10-30(22,29)5/h7,19-23,32-34H,8-17H2,1-6H3,(H,35,36)/t19-,20-,21+,22+,23-,26-,27-,28-,29+,30+,31-/m0/s1
InChI Key CYJWWQALTIKOAG-FLORRLIPSA-N
MDL Number MFCD09953799
Molecular Formula C31H48O7
Molecular Weight 532.7086
SMILES C[C@]12C([C@]3([C@@](C(O)=O)(CC1)CC[C@@](C(OC)=O)(C)C3)[H])=CC[C@]4([C@@]2(C)CC[C@@]5([C@]4(C)C[C@H](O)[C@H](O)[C@]5(CO)C)[H])[H]
UNII 18YX12Q68B
Synonyms
Phytolaccagenin, 1802-12-6, UNII-18YX12Q68B, 18YX12Q68B, Phytolaccagenine, Jaligonic acid 30-methyl ester, C31H48O7, Olean-12-ene-28,29-dioic acid, 2,3,23-trihydroxy-, 29-methyl ester, (2beta,3beta,4alpha,20beta)-, NSC 116453, SCHEMBL1050612, MFCD09953799, ZINC96023840, (2beta,3beta,4alpha,20beta)-29-Methyl 2,3,23-trihydroxyolean-12-ene-28,29-dioate, W2529, Q-100213, Praeruptorin D, ACN-047093, C31-H48-O7,

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