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AG009CEQ

134404-52-7 | Seocalcitol

Chemical structure of Seocalcitol, CAS 134404-52-7
AG009CEQ
sdsSDS
sdsCOA
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CAS Number 134404-52-7
Catalog Number AG009CEQ(AGN-PC-0PKA0T)
Chemical Name Seocalcitol
IUPAC Name (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,3E,5E)-7-ethyl-7-hydroxynona-3,5-dien-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
InChI InChI=1S/C30H46O3/c1-6-30(33,7-2)18-9-8-11-21(3)26-15-16-27-23(12-10-17-29(26,27)5)13-14-24-19-25(31)20-28(32)22(24)4/h8-9,11,13-14,18,21,25-28,31-33H,4,6-7,10,12,15-17,19-20H2,1-3,5H3/b11-8+,18-9+,23-13+,24-14-/t21-,25-,26-,27+,28+,29-/m1/s1
InChI Key LVLLALCJVJNGQQ-SEODYNFXSA-N
MDL Number MFCD00871599
Molecular Formula C30H46O3
Molecular Weight 454.6844
SMILES C=C1[C@@H](O)C[C@H](O)C/C1=C/C=C2[C@@]3([H])[C@]([C@]([C@H](C)/C=C/C=C/C(CC)(O)CC)([H])CC3)(C)CCC/2
UNII Q0OZ0D9223
Synonyms
1(S),3(R)-dihydroxy-20(R)-(5'-ethyl-5'-hydroxyhepta-1'(E),3'(E)-dien-1'-yl)-9,10-secopregna-5(Z),7(E),10(19)-triene, EB 1089, EB-1089, EB1089, seocalcitol, Seocalcitol, 134404-52-7, UNII-Q0OZ0D9223, EB-1089, Q0OZ0D9223, EB1089, EB 1089, Seocalcitol [INN:BAN], CB-1089, (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,3E,5E)-7-ethyl-7-hydroxynona-3,5-dien-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol, (22E,24E)-1alpha,25-dihydroxy-26,27-dimethyl-22,23,24,24a-tetradehydro-24a-homovitamin D3 / (22E,24E)-1alpha,25-dihydroxy-26,27-dimethyl-22,23,24,24a-tetradehydro-24a-homocholecalciferol, 1(S),3(R)-Dihydroxy-20(R)-(5'-ethyl-5'-hydroxyhepta-1'(E),3'(E)-dien-1'-yl)-9,10-secopregna-5(Z),7(E),10(19)-triene, 1,3-Cyclohexanediol, 5-((2E)-((1R,3aS,7aR)-1-((1R,2E,4E)-6-ethyl-6-hydroxy-1-methyl-2,4-octadienyl)octahydro-7a-methyl-4H-inden-4-ylidene)ethylidene)-4-methylene-, (1R,3S,5Z)-, AC1NRAXQ, W-5186, GTPL2777, 22-24-DIENE-24A,26A,27A,TRIHOMO-1ALPHA,25-DIHYDROXYVITAMIN D3, CHEMBL1908376, SCHEMBL12028975, LVLLALCJVJNGQQ-SEODYNFXSA-N, (5Z,7E,22E,24E)-24a,26a,27a-Trihomo-9,10-secocholesta-5,7,10(19),22,24-pentaene-1alpha,3beta,25-triol, 1,3-Cyclohexanediol, 5-((1-(6-ethyl-6-hydroxy-1-methyl-2,4-octadienyl)octahydro-7a-methyl-4H-inden-4-ylidene)ethylidene)-4-methylene-, (1R-(1alpha(1R*,2E,4E),3abeta,4E(1R*,3S*,5Z),7aalpha))-, ZINC3925433, 4036AH, LMST03020449, MFCD00871599, AKOS024457918, CS-0398, HY-32341, EB1089, >=98% (HPLC), EB 1089;EB-1089;EB1089, 404S527, (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(1R,2E,4E)-6-Ethyl-6-hydroxy-1-methyl-2,4-octadien-1-yl]-octahydro-7?-methyl-4H-inden-4-ylidene]ethylidene]-4-methylene-1,3-cyclohexanediol, (1R,3S,5Z)-5-[(2E)-2-{(1R,3aS,7aR)-1-[(1R,2E,4E)-6-ethyl-6-hydroxy-1-methylocta-2,4-dien-1-yl]-7a-methyloctahydro-4H-inden-4-ylidene}ethylidene]-4-methylidenecyclohexane-1,3-diol (non-preferred name), 5-{2-[1-(6-ETHYL-6-HYDROXY-1-METHYL-OCTA-2,4-DIENYL)-7A-METHYL-OCTAHYDRO-INDEN-4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-CYCLOHEXANE-1,3-DIOL, 5-{2-[1-(6-ETHYL-6-HYDROXY-1-METHYL-OCTA-2,4-DIENYL)-7A-METHYL-OCTAHYDRO-INDEN-4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-CYCLOHEXANE-1,3-DIOL; 22-24-DIENE-24A,26A,27A,TRIHOMO-1ALPHA,25-DIHYDROXYVITAMIN D3, Seocalcitol;, D09ZJQ, C30H46O3, SP W 5186, SP-W-5186, C30-H46-O3, CID5288149, SP 5186, C078903, C115703, N-(3-nitratopivaloyl)-S-(N'-acetylglycyl)-L-cysteine ethylester, (5Z,7E,22E,24E)-(1S,3R)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19),22,24-cholestapentaene-1,3,25-triol, (5Z,7E,22E,24E)-24a,26a,27a-trihomo-9,10-secocholesta-5,7,10(19),22,24-pentaene-1-alpha,3-beta,25-triol, EB1,

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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
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    Reviewed by:Jessie
    Date:
    Angene International Limited