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Methylcobalamin

Also known as C63H91CoN13O14P

Formula C63H91CoN13O14PMolar mass 1,344.41 g/molEC 236-535-3
Methylcobalamin chemical structure, C63H91CoN13O14P
2D chemical structure

Key facts

What buyers check first

Formula
C63H91CoN13O14P
Molar mass
1,344.41 g/mol
EC number
236-535-3
HS code
293626
Category
Nucleosides and nucleotides

What is Methylcobalamin?

Plain description, key identifiers and synonyms

Methylcobalamin is a chemical substance with the molecular formula C63H91CoN13O14P and a molar mass of 1,344.41 g/mol. The IUPAC name is carbanide, cobalt(3+), [5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] 1-[3-[(5Z,10Z,15Z)-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.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
carbanide, cobalt(3+), [5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] 1-[3-[(5Z,10Z,15Z)-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
EC number
236-535-3
Molecular formula
C63H91CoN13O14P
InChI
InChI=1S/C62H90N13O14P.CH3.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;;/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;/q;-1;+3/p-2
Canonical SMILES
CC1=C2N=C(C=C3N=C(C(C)=C4[N-]C(C)(C5N=C1C(C)(CCC(=O)NCC(C)OP(=O)([O-])OC1C(CO)OC(n6cnc7cc(C)c(C)cc76)C1O)C5CC(N)=O)C(C)(CC(N)=O)C4CCC(N)=O)C(C)(CC(N)=O)C3CCC(N)=O)C(C)(C)C2CCC(N)=O.[CH3-].[Co+3]
Isomeric SMILES
[CH3-].CC1=CC2=C(C=C1C)N(C=N2)C3C(C(C(O3)CO)OP(=O)([O-])OC(C)CNC(=O)CCC4(C(C5C6(C(C(/C(=C(/C7=N/C(=C\C8=N/C(=C(\C4=N5)/C)/C(C8(C)C)CCC(=O)N)/C(C7(C)CC(=O)N)CCC(=O)N)\C)/[N-]6)CCC(=O)N)(C)CC(=O)N)C)CC(=O)N)C)O.[Co+3]

Synonyms

  • C63H91CoN13O14P

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
1,344.41 g/molcalc.
Exact mass
1,343.5878 Dacalc.
LogP (octanol/water)
3.76calc.
Topological polar surface area
464.9 Ųcalc.
Hydrogen bond donors
9calc.
Hydrogen bond acceptors
18calc.
Rotatable bonds
26calc.
Heavy atoms
92calc.
Rings
8calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.62calc.
Formal charge
0calc.
Stereocentres
15calc.
Components
3calc.
Lipinski rule of five
Fails (3 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C(CCC1CC2N=C1C=C1CCC(=N1)C=C1CCC(=N1)C=C1CCC2N1)NCCO[PH](=O)OC1COC(n2cnc3ccccc32)C1

O=C(CCC1CC2N=C1C=C1CCC(=N1)C=C1CCC(=N1)C=C1CCC2N1)NCCO[PH](=O)OC1COC(n2cnc3ccccc32)C1

8 rings, 48 atoms.

15 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Methylcobalamin suppliers

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Methylcobalamin price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Methylcobalamin is traded under.

HS 2936.26Indicative HS code

Vitamin B12 and its derivatives

World exports in 2024
$306M
+16.8% vs 2023, imports $308M
2019 to 2024
Top exporters
  1. China47.1%
  2. France * partner reported12.0%
  3. United States10.1%
Top importers
  1. United States23.0%
  2. India * partner reported9.8%
  3. Netherlands7.9%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Methylcobalamin is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Methylcobalamin, based on the data on this page

What is Methylcobalamin?

Methylcobalamin is a chemical substance with the molecular formula C63H91CoN13O14P and a molar mass of 1,344.41 g/mol.

What is the molecular formula and weight of Methylcobalamin?

The molecular formula of Methylcobalamin is C63H91CoN13O14P and its molar mass is 1,344.41 g/mol.

What is Methylcobalamin used for?

Known uses and roles of Methylcobalamin include vitamins and supplements in pharmaceuticals, vitamins, minerals and nutrients in food and beverage and feed vitamins in animal feed and nutrition.

Is Methylcobalamin hazardous?

No GHS hazard classification for Methylcobalamin is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Methylcobalamin?

Methylcobalamin is usually classified under HS code 293626 (Vitamin B12 and its derivatives). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Methylcobalamin?

CompoundList lists 16 suppliers of Methylcobalamin in India, China, United States, Canada and 1 more. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

Where can I buy Methylcobalamin in India?

6 suppliers in India list Methylcobalamin on CompoundList. Filter the suppliers list by country and send a request to compare prices, grades and delivery times.

What is the price of Methylcobalamin?

Suppliers quote Methylcobalamin on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Methylcobalamin

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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