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AG01DQ13

101312-92-9 | Valnemulin

Chemical structure of Valnemulin, CAS 101312-92-9
AG01DQ13
sdsSDS
sdsCOA

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CAS Number 101312-92-9
Catalog Number AG01DQ13(AGN-PC-0OQJ84)
Chemical Name Valnemulin
IUPAC Name [(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[1-[[(2R)-2-amino-3-methylbutanoyl]amino]-2-methylpropan-2-yl]sulfanylacetate
InChI InChI=1S/C31H52N2O5S/c1-10-29(8)15-22(38-23(35)16-39-28(6,7)17-33-27(37)24(32)18(2)3)30(9)19(4)11-13-31(20(5)26(29)36)14-12-21(34)25(30)31/h10,18-20,22,24-26,36H,1,11-17,32H2,2-9H3,(H,33,37)/t19-,20+,22-,24-,25+,26+,29-,30+,31+/m1/s1
InChI Key LLYYNOVSVPBRGV-MVNKZKPCSA-N
MDL Number MFCD09832850
Molecular Formula C31H52N2O5S
Molecular Weight 564.8200
SMILES O=C1CC[C@@]2(CC[C@H]3C)[C@@H](C)[C@H](O)[C@@](C=C)(C)C[C@@H](OC(CSC(C)(C)CNC([C@H](N)C(C)C)=O)=O)[C@@]3(C)[C@@]21[H]
UNII 2AHC415BQG
Synonyms
Econor, valnemulin, Valnemulin, Econor, UNII-2AHC415BQG, 2AHC415BQG, 101312-92-9, Valnemulin [INN:BAN], NCGC00167968-01, DSSTox_CID_26751, DSSTox_RID_81876, DSSTox_GSID_46751, SCHEMBL216709, CHEMBL1688852, DTXSID2046751, Tox21_112596, ZINC30727788, ((2-((R)-2-Amino-3-methylbutyramido)-1,1-dimethylethyl)thio)acetic acid, 8-ester with (3aS,4R,5S,6S,8R,9R,9aR,10R)-octahydro-5,8-dihydroxy-4,6,9,10-tetramethyl-6-vinyl-3a,9-propano-3aH-cyclopentacycloocten-1(4H)-one, CAS-101312-92-9, AB01566922_01, Acetic acid,[[2-[[(2R)-2-amino-3-methyl-1-oxobutyl]amino]-1,1-dimethylethyl]thio]-,(3aS,4R,5S,6S,8R,9R,9aR,10R)-6-ethenyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3aH-cyclopentacycloocten-8-ylester, Valnemulin [INN], C31H52N2O5S, C31-H52-N2-O5-S, CID9850878, C117845, 14-O-[1-(D-2-amino-3-methylbutyrylamino)-2-methylpropan-2-ylthioacetyl]mutilin,

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    Conclusion: The above product meets the specifications of Angene.
    Analyst:Chase
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    Reviewed by:Jessie
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    Angene International Limited