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AG007RJD

112965-21-6 | Calcipotriol

Chemical structure of Calcipotriol, CAS 112965-21-6
AG007RJD
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CAS Number 112965-21-6
Catalog Number AG007RJD(AGN-PC-0P46QS)
Chemical Name Calcipotriol
EC Number 601-218-4
IUPAC Name (1R,3S,5Z)-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-UROSTWAQSA-N
MDL Number MFCD10567086
Molecular Formula C27H40O3
Molecular Weight 412.6047
SMILES C1(CC1)[C@@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2C(CCC[C@]12C)=CC=C1/C([C@H](C[C@@H](C1)O)O)=C)O
UNII 143NQ3779B
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, Calcipotriol, calcipotriene, Dovonex, Daivonex, Psorcutan, Sorilux, 112965-21-6, MC 903, MC-903, UNII-143NQ3779B, CHEBI:50749, Calcipotriene [USAN], CALCIPOTRIENE HYDRATE, Calcipotriol hydrate, 143NQ3779B, Calcipotriene (USAN), NCGC00167465-01, Calciptriol, 112828-00-9, DSSTox_CID_26648, DSSTox_RID_81793, DSSTox_GSID_46648, (1R,3S,5Z)-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, CCRIS 7700, Calcitrene, Divonex, (22E)-(24S)-1alpha,24-dihydroxy-26,27-cyclo-22,23-didehydrovitamin D3 / (22E)-(24S)-1alpha,24-dihydroxy-26,27-cyclo-22,23-didehydrocholecalciferol / Calcipotriol, (5Z,7E,22E)-(1S,3R,24S)-26,27-cyclo-9,10-seco-5,7,10(19),22-cholestatetraene-1,3,24-triol, SMR000466353, Dovonex (TN), CAS-112965-21-6, SR-01000762910, MFCD10567086, (5Z,7E,22E,24S)-24-Cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1alpha,3beta,24-triol, CPD000466353, PRI 2201, Calcipotriol (JAN), Calcipotriol [INN], BMS-181161, PubChem18810, PubChem19334, AC1NRC3V, Epitope ID:114242, SCHEMBL2853, MLS000759467, MLS001424130, GTPL2778, CHEMBL1200666, DTXSID0046648, 1s19, LWQQLNNNIPYSNX-UROSTWAQSA-N, 1-ALPHA,24S-(OH)2-22-ENE-26,27-DEHYDROVITAMIN D3, HMS2051N11, HMS2089J08, HMS3269P03, HMS3677D04, HMS3713K08, MC903, 9,10-Secochola-5,7,10(19),22-tetraene-1,3,24-triol, 24-cyclopropyl-, (1alpha,3beta,5Z,7E,22E,24S)-, ZINC3921872, Tox21_112469, BDBM50369964, LMST03020106, AKOS015855239, Tox21_112469_1, CCG-100949, CS-0387, DB02300, NC00199, STF-115469, NCGC00167465-02, (1S,5Z,7Z,17ALPHA,22E)-24-CYCLOPROPYL-9,10-SECOCHOLA-5,7,10,22-TETRAENE-1,3,24-TRIOL, HY-10001, O763, D01125, U-0267, W-5148, 24207-EP2275420A1, 24207-EP2295055A2, 24207-EP2295416A2, 24207-EP2298748A2, 24207-EP2298764A1, 24207-EP2298765A1, 24207-EP2305640A2, 24207-EP2305642A2, 24207-EP2308861A1, 24207-EP2311453A1, 24207-EP2314590A1, AB00698343-05, 828C009, Calciptriol, MC-903, Daivonex, Dovonex, Psorcutan, SR-01000762910-3, SR-01000762910-4, (1?,3?,5Z,7E,22E,24S)-24-Cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1,3,24-triol, (1R,3S,5Z)-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, (1S,3R,5Z,7E,14beta,17alpha,22E,24S)-26,27-cyclo-9,10-secocholesta-5,7,10,22-tetraene-1,3,24-triol, (1S,5Z,7Z,17ALPHA,22E)-24-CYCLOPROPYL-9,10-SECOCHOLA-5,7,10,22-TETRAENE-1,3,24-TRIOL; 1-ALPHA,24S-(OH)2-22-ENE-26,27-DEHYDROVITAMIN D3, (5Z,7E,22E,24S)-24-Cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1alpha,3beta,24-triol hydrate, (5Z,7E,24S)-26,27-Cyclo-9,10-secocholesta-5,7,10(19),22-tetraene-1alpha,3beta,24-triol, Enstilar, heximar win care, Daivonex (TN), D01QUS, C27H40O3, PRI-2205, ACN-032164, C27-H40-O3, CID5288783, CS-O-06254, 1,24(OH)2-22-ene-24-cyclopropyl D3, C055085, (1-alpha,3-beta,5Z,7E,22E,24S)-24-cyclopropyl-9,10-secochola-5,7,10(19),22-tetraene-1,3,24-triol, 147657-22-5, 9,10-Secochola-5,7,10(19),22-tetraene-1,3,24-triol, 24-cyclopropyl-, (1alpha,3beta,5Z,7E,22E)-, MC9,

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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