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AG01CCF3

113082-99-8 | 9,10-Secochola-5,7,10(19),22-tetraene-1,3,24-triol, 24-cyclopropyl-,(1a,3b,5E,7E,22E,24S)-

Chemical structure of 9,10-Secochola-5,7,10(19),22-tetraene-1,3,24-triol, 24-cyclopropyl-,(1a,3b,5E,7E,22E,24S)-, CAS 113082-99-8
AG01CCF3
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CAS Number 113082-99-8
Catalog Number AG01CCF3(AGN-PC-0P4CR1)
Chemical Name 9,10-Secochola-5,7,10(19),22-tetraene-1,3,24-triol, 24-cyclopropyl-,(1a,3b,5E,7E,22E,24S)-
EC Number 601-218-4
IUPAC Name (1R,3S,5E)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
InChI InChI=1S/C27H40O3/c1-17(6-13-25(29)20-8-9-20)23-11-12-24-19(5-4-14-27(23,24)3)7-10-21-15-22(28)16-26(30)18(21)2/h6-7,10,13,17,20,22-26,28-30H,2,4-5,8-9,11-12,14-16H2,1,3H3/b13-6+,19-7+,21-10+/t17-,22-,23-,24+,25-,26+,27-/m1/s1
InChI Key LWQQLNNNIPYSNX-GMGGYIQASA-N
MDL Number MFCD30478844
Molecular Formula C27H40O3
Molecular Weight 412.6047
SMILES C1(CC1)[C@@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2\C(\CCC[C@]12C)=C\C=C/1\C([C@H](C[C@H](C1)O)O)=C)O
UNII QRA3492A7Q
Synonyms
1,24(OH)2-22-ene-24-cyclopropyl D3, calcipotriene, calcipotriol, Daivonex, Dovonex, Enstilar, heximar win care, MC 903, MC-903, PRI-2205, Psorcutan, Sorilux, 5,6-trans-Calcipotriol, (5E)-Calcipotriene, UNII-QRA3492A7Q, PRI 2205, calcipotriene, QRA3492A7Q, 113082-99-8, Calcipotriol Impurity C, (5E)-Calcipotriol, Calcipotriol, (5E)-, 112965-21-6, PRI-2205, Calcipotriol, anhydrous impurity C [EP], Calcipotriol, anhydrous specified impurity C [EP], BIDD:GT0282, SCHEMBL2131847, ZINC77285174, AKOS024457248, (5E,7E,22E,24S)-24-Cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1alpha,3beta,24-triol, 1,3-Cyclohexanediol, 5-((2E)-2-((1R,3aS,7aR)-1-((1R,2E,4S)-4-cyclopropyl-4-hydroxy-1-methyl-2-buten-1-yl)octahydro-7a-methyl-4H-inden-4-ylidene)ethylidene)-4-methylene-, (1S,3S,5E)-, 9,10-Secochola-5,7,10(19),22-tetraene-1,3,24-triol, 24-cyclopropyl-, (1alpha,3beta,5E,7E,22E,24S)-, BRD-K56429665-001-03-9, (1|A,3|A,5E,7E,22E,24S)-24-Cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1,3,24-triol, (1S,3S,5E)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(1R,2E,4S)-4-Cyclopropyl-4-hydroxy-1-methyl-2-buten-1-yl]octahydro-7a-methyl-4H-inden-4-ylidene]ethylidene]-4-methylene-1,3-cyclohexanediol, Calcipotriol, Calciptriol, Calcitrene, Daivonex, Psorcutan, Dovonex, Sorilux, Calcipotriene [USAN], CCRIS 7700, UNII-143NQ3779B, PRI 2201, MC 903, C27-H40-O3, CID9801803, (1-alpha,3-beta,5Z,7E,22E,24S)-24-cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1,3,24-triol, (1R,3S,E)-5-((E)-2-((1R,3aR,7aR)-1-((2R,5S,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methyldihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol, (5Z,7E,22E,24S)-24-Cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1alpha,3beta,24-triol,

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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