cyano[(1R,2R,3R,4R,6Z,8S,11Z,13S,14S,16Z,18S,19S)-8,13,18-tris(2-carbamoylethyl)-3,14,19-tris(carbamoylmethyl)-4-(2-{[(2R)-2-{[(2R,3S,4R,5S)-5-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl phosphonato]oxy}propyl]carbamoyl}ethyl)-1,4,6,9,9,14,16,19-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.1²,⁵.1⁷,¹⁰.1¹²,¹⁵]tricosa-5(23),6,10(22),11,15(21),16-hexaen-20-yl]cobaltylium

Compound number:
MolPort-016-633-264
CAS number: 68-19-9
IUPAC:
cyano[(1R,2R,3R,4R,6Z,8S,11Z,13S,14S,16Z,18S,19S)-8,13,18-tris(2-carbamoylethyl)-3,14,19-tris(carbamoylmethyl)-4-(2-{[(2R)-2-{[(2R,3S,4R,5S)-5-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl phosphonato]oxy}propyl]carbamoyl}ethyl)-1,4,6,9,9,14,16,19-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.1²,⁵.1⁷,¹⁰.1¹²,¹⁵]tricosa-5(23),6,10(22),11,15(21),16-hexaen-20-yl]cobaltylium
IUPAC traditional:
cyano[(1R,2R,3R,4R,6Z,8S,11Z,13S,14S,16Z,18S,19S)-8,13,18-tris(2-carbamoylethyl)-3,14,19-tris(carbamoylmethyl)-4-(2-{[(2R)-2-{[(2R,3S,4R,5S)-5-(5,6-dimethyl-1,3-benzodiazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl phosphonato]oxy}propyl]carbamoyl}ethyl)-1,4,6,9,9,14,16,19-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.1²,⁵.1⁷,¹⁰.1¹²,¹⁵]tricosa-5(23),6,10(22),11,15(21),16-hexaen-20-yl]cobaltylium
SMILES:
C[C@H](CNC(=O)CC[C@]1(C)[C@@H](CC(N)=O)[C@H]2N=C1\C(C)=C1/N=C(/C=C3\N=C(\C(\C)=C4\[C@@H](CCC(N)=O)[C@](C)(CC(N)=O)[C@@]2(C)N4[Co+]C#N)[C@@](C)(CC(N)=O)[C@@H]3CCC(N)=O)C(C)(C)[C@@H]1CCC(N)=O)OP([O-])(=O)O[C@@H]1[C@@H](CO)O[C@@H]([C@@H]1O)n1cnc2cc(C)c(C)cc12 |r,c:16,20,24,t:22,26,29|
InChI key:
RMRCNWBMXRMIRW-WZHZPDAFSA-L
Molecular formula:
C63H88CoN14O14P
Molecular weight: 1355.388
Solubility: not available

Marketplace Offers

S&H to USA: 17.00 USD
S&H to World: 120.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 2 business days Purity: 98% (HPLC)
Last updated: this month In warehouse: 60.26 g
Pack size Ships out Price Qty
100 mg February 26, 2020 19.00 USD
ADD TO CART
500 mg February 26, 2020 25.00 USD
ADD TO CART
1 g February 26, 2020 45.00 USD
ADD TO CART
S&H to USA: 80.00 USD
S&H to World: 100.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 10 business days Purity: 98%
Last updated: last month In warehouse: 25.00 g
Pack size Ships out Price Qty
1 g March 9, 2020 29.00 USD
ADD TO CART
5 g March 9, 2020 121.00 USD
ADD TO CART
10 g March 9, 2020 217.00 USD
ADD TO CART
S&H to USA: 80.00 USD
S&H to World: 100.00 USD

Supplier Catalogue Data


Catalog: Building blocks Ships out: 10 business days Purity: 98%
Last updated: > 3 months ago In warehouse: Unverified
Pack size Ships out Price Qty
100 mg March 9, 2020 59.00 USD
ADD TO CART
500 mg March 9, 2020 68.00 USD
ADD TO CART
1 g March 9, 2020 96.00 USD
ADD TO CART
S&H to USA: 105.00 USD
S&H to World: 105.00 USD

Supplier Catalogue Data


Catalog: Made to order Ships out: 30 business days Purity: n/a
In warehouse: Made to order
Pack size Ships out Price Qty
5 g April 6, 2020 208.86 USD
ADD TO CART

More Information

Compound Identifiers
Compound number: MolPort-016-633-264
CAS number: 68-19-9

Names, Synonyms and 3rd Party Identifiers
Name: MFCD00151092
Cyanocobalamin
Cobalamin, vitamin B-12, Cyanocobalamin
Vitamin b12
Vitamin B12, USP grade

InChI
InChI: 1S/C62H90N13O14P.CN.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;/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);;/q;;+2/p-2/t31-,34-,35-,36-,37+,41-,52-,53-,56-,57+,59-,60+,61+,62+;;/m1../s1
InChI key: RMRCNWBMXRMIRW-WZHZPDAFSA-L

Calculated Properties
Molecular formula: C63H88CoN14O14P
Molecular weight: 1355.388

Other

Sales contact

+1 215 717 7447

+371 67790398

sales@molport.com


Our customer services department will be happy to help you Monday to Friday 7 a.m. to 9 p.m. GMT (2 a.m. - 4 p.m. EST).


2020 MolPort, v3.5, release date 34-02-2020 17:00 (+0200). All rights reserved.
This website or its third-party tools use cookies, which are necessary to its functioning and require to achieve the purposes illustrated in the Cookie Policy. If you want to know more or withdraw your consent to all or some of the cookies, please refer to the Cookie Policy. By clicking on Agree and closing this banner, scrolling this page, clicking a link or continuing to browse otherwise, you agree to the use of cookies.