Cobinamide,co-(cyano-kc)-,dihydrogen phosphate(ester),inner salt,3'-ester with(5,6-Dichloro-1-a-d-ribofuranosyl-1H-benzimidazole-kn3)

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CAS
60607-61-6
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Purity
96%
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Catalog Number

ACM60607616

Product Name

Cobinamide,co-(cyano-kc)-,dihydrogen phosphate(ester),inner salt,3'-ester with(5,6-Dichloro-1-a-d-ribofuranosyl-1H-benzimidazole-kn3)

CAS

60607-61-6

Category

Heterocyclic Organic Compound

Synonyms

NSC514683, NSC-514683, 60607-61-6, Cobinamide, dihydrogen phosphate (ester), inner salt, 3-ester with 5,6-dichloro-1-.alpha.-D-ribofuranosyl-1H-benzimidazole

IUPAC Name

cobalt(2+);[5-(5,6-dichlorobenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] 1-[3-[(4Z,9Z,14Z)-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-21-id-3-yl]propanoylam

Molecular Weight

1397.2101

Molecular Formula

C₆₁H₈₂Cl₂CoN₁₄O₁₄P

Canonical SMILES

CC1=C2C(C(C([N-]2)C3(C(C(C(=N3)C(=C4C(C(C(=N4)C=C5C(C(C1=N5)CCC(=O)N)(C)C)CCC(=O)N)(C)CC(=O)N)C)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)(C)CCC(=O)NCC(C)OP(=O)(O)OC6C(OC(C6O)N7C=NC8=CC(=C(C=C87)Cl)Cl)CO.[C-]#N.[Co+2]

InChI Key

QOXROFSESWNTAI-UHFFFAOYSA-M

Density

g/cm³

Exact Mass

1395.47000

H-Bond Acceptor

H-Bond Donor

MSDS

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COA

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