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AG00C4GF

301845-97-6 | Simocyclinone D8

Chemical structure of Simocyclinone D8, CAS 301845-97-6
AG00C4GF
sdsSDS
sdsCOA
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CAS Number 301845-97-6
Catalog Number AG00C4GF(AGN-PC-0R5KLS)
Chemical Name Simocyclinone D8
IUPAC Name [(2R,3R,4R,6R)-3-acetyloxy-2-methyl-6-(2,7,9,11,13-pentahydroxy-5-methyl-3,18-dioxo-19-oxapentacyclo[8.8.1.01,10.02,7.012,17]nonadeca-4,12(17),13,15-tetraen-14-yl)oxan-4-yl] (2E,4E,6E,8E)-10-[(8-chloro-4,7-dihydroxy-2-oxochromen-3-yl)amino]-10-oxodeca-2,4,6,8-tetraenoate
InChI InChI=1S/C46H42ClNO18/c1-20-16-29(51)45(61)43(60,18-20)19-30(52)44-41(58)33-24(40(57)46(44,45)66-44)13-12-23(36(33)55)27-17-28(38(21(2)62-27)63-22(3)49)64-32(54)11-9-7-5-4-6-8-10-31(53)48-35-37(56)25-14-15-26(50)34(47)39(25)65-42(35)59/h4-16,21,27-28,30,38,41,50,52,55-56,58,60-61H,17-19H2,1-3H3,(H,48,53)/b6-4+,7-5+,10-8+,11-9+/t21-,27-,28-,30?,38-,41?,43?,44?,45?,46?/m1/s1
InChI Key PLEGMCYXNQPJNV-TYXWGSLYSA-N
MDL Number MFCD28899076
Molecular Formula C33H44N2O13
Molecular Weight 676.7081
SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](O[C@H](C)C(O)=O)[C@@H](NC(C)=O)[C@@H](OCC3=CC=CC=C3)O[C@@H]2COCC4=CC=CC=C4)[C@H](NC(C)=O)[C@@H](O)[C@@H]1O
Synonyms
simocyclinone D8, Simocyclinone D8, 301845-97-6, CID 9919367, CID10653410,

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    CERTIFICATE OF ANALYSIS
    Chemical Name: Batch Number:
    Chemical Structure: CAS Registry No:
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    Manufacture Date:
    Storage Temperature:
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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