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Product Overview

Product Code

TRC-S699360

Product Format

Neat

Molecular Formula

C62H88CoN13NaO17PS

Molecular Weight

1432.4

API Family

Hydroxocobalamin Acetate

Product Categories

TRC, Impurity Reference Materials

Product Type

Impurity

Alternate CAS Number

Inner salt: 15671-27-9

Documentation

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Product Information

Chemical Data

Analyte Name

Sulfitocobalamin Sodium Salt

Molecular Formula

C62H88CoN13NaO17PS

Molecular Weight

1432.4

SMILES

>>NC(CC1(C)C(CCC(N)=O)C2=N/C1=C(C)\C3=NC(C(C(CC(N)=O)C/4(CCC(NCC(OP(O[C@H]5[C@@H](O)[C@@H](N6C=[N+]([Co+]OS(O[Na])=O)C7=C6C=C(C)C(C)=C7)O[C@@H]5CO)([O-])=O)C)=O)C)[N-]C4=C(C)/C(C(CCC(N)=O)C/8(C)C)=NC8=C/2)(C)C(CC(N)=O)(C)C3CCC(N)=O)=O

InChI

InChI=1S/C62H90N13O14P.Co.H2O3S/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;;1-4(2)3/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);;(H2,1,2,3)/q;+3;/p-3

Alternate CAS Number

Inner salt: 15671-27-9

Product Data

Storage Temperature

-20°C

Shipping Temperature

Blue Ice

Country of Origin

CANADA

Product Format

Neat

API Family

Hydroxocobalamin Acetate

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Product Overview

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Chemical Data

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Sulfitocobalamin Sodium Salt

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