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AG00I4FP

22465-48-1 | Acetatocobalamin

Chemical structure of Acetatocobalamin, CAS 22465-48-1
AG00I4FP
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CAS Number 22465-48-1
Catalog Number AG00I4FP(AGN-PC-0QZ1I3)
Chemical Name Acetatocobalamin
EC Number 245-019-7
IUPAC Name acetic acid;cobalt;[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] 1-[3-[(1R,2R,3R,5Z,7S,10Z,12S,13S,15Z,17S,18S,19R)-2,13,18-tris(2-amino-2-oxoethyl)-7,12,17-tris(3-amino-3-oxopropyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-24-id-3-yl]propanoylamino]propan-2-yl phosphate
InChI InChI=1S/C62H90N13O14P.C2H4O2.Co/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)80)56-62(11)61(10,25-48(68)82)36(14-17-45(65)79)51(74-62)33(5)55-60(9,24-47(67)81)34(12-15-43(63)77)38(71-55)23-42-58(6,7)35(13-16-44(64)78)50(72-42)32(4)54(59)73-56;1-2(3)4;/h20-21,23,28,31,34-37,41,52-53,56-57,76,84H,12-19,22,24-27H2,1-11H3,(H15,63,64,65,66,67,68,69,71,72,73,74,77,78,79,80,81,82,83,85,86);1H3,(H,3,4);/p-2/t31?,34-,35-,36-,37+,41-,52-,53-,56-,57+,59-,60+,61+,62+;;/m1../s1
InChI Key JEINOAHBVLNVDD-WYVZQNDMSA-L
MDL Number MFCD00082532
Molecular Formula C64H95CoN13O16P
Molecular Weight 1392.4236
SMILES [O-]([Co+3]1234N5=CN(C6OC(C(OP(OC(CNC(CCC7(C(C8C9(C(C(C(C(=C%10C(C(C(C=C%11C(C(C(/C(=C/7[N-]18)/C)=N2%11)CCC(=O)N)(C)C)=N3%10)CCC(=O)N)(C)CC(=O)N)C)=N49)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)=O)C)([O-])=O)C6O)CO)C1=CC(=C(C=C51)C)C)C(=O)C
Synonyms
Hydroxocobalamin acetate, Vitamin B12a acetate, MFCD00082532, 22465-48-1, DMACM-caged 8-Br-cGMP, Hydroxocobalamin acetate, vitamin B12 analog, Hydroxocobalamin acetate, United States Pharmacopeia (USP) Reference Standard, Twelvmin, Fresmin S, ACETATOCOBALAMIN, Hydroxocobalamine acetate, HYDROXOCOBALAMINACETATE, Cobalamin, acetato- (6CI), UNII-S535M27N3Q, Hydroxocobalamin acetate [JAN], EINECS 245-019-7, C64-H91-Co-N13-O16-P, Co(Acetato-kappaO)cobinamide dihydrogen phosphate (ester), inner salt, 3'-ester with (5,6-dimethyl-1-alpha-D-ribofuranosyl-1H-benzimidazole-kappaN3), Cobinamide, acetate (salt) hydroxide, dihydrogen phosphate (ester), inner salt, 3'-ester with 5,6-dimethyl-1-.alpha.-D-ribofuranosyl-1H-benzimidazole, Cobinamide, Co-(acetato-.kappa.O)-, dihydrogen phosphate (ester), inner salt, 3'-ester with (5,6-dimethyl-1-.alpha.-D-ribofuranosyl-1H-benzimidazole-.kappa.N3),

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    CERTIFICATE OF ANALYSIS
    Chemical Name: Batch Number:
    Chemical Structure: CAS Registry No:
    		Product ID:
    Manufacture Date:
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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