V677005
Co-(cyano-κC)-Cobinamide dihydrogen phosphate (ester) inner salt 3′-ester with (1,3-dihydro-5,6-dimethyl-1-alpha-D-ribofuranosyl-2H-benzimidazol-2-one-κN3)
Trivial name | Co-(cyano-κC)-Cobinamide dihydrogen phosphate (ester) inner salt 3'-ester with (1,3-dihydro-5,6-dimethyl-1-alpha-D-ribofuranosyl-2H-benzimidazol-2-one-κN3) |
Catalog Number | TRC-V677005-5MG |
Alternative Name(s) | Cobinamide cyanide dihydrogen phosphate (ester) inner salt 3'-ester with 1,3-dihydro-5,6-dimethyl-1-alpha-D-ribofuranosyl-2H-benzimidazol-2-one |
Molecular Formula | C₆₃H₈₈CoN₁₄O₁₅P |
CAS# | 119157-02-7 |
Inchi | InChI=1S/C62H90N13O15P.CN.Co/c1-28-20-38-39(21-29(28)2)75(57(85)71-38)56-51(84)52(40(27-76)88-56)90-91(86,87)89-30(3)26-69-48(83)18-19-59(8)36(22-45(66)80)55-62(11)61(10,25-47(68)82)35(14-17-44(65)79)50(74-62)32(5)54-60(9,24-46(67)81)33(12-15-42(63)77)37(70-54)23-41-58(6,7)34(13-16-43(64)78)49(72-41)31(4)53(59)73-55;1-2;/h20-21,23,30,33-36,40,51-52,55-56,76,84H,12-19,22,24-27H2,1-11H3,(H16,63,64,65,66,67,68,69,70,71,72,73,74,77,78,79,80,81,82,83,85,86,87);;/q;;+4/p-2 |
SMILES | NC(CC1(C)C(CCC(N)=O)C2=CC3=[N]4C(C(CCC(N)=O)C3(C)C)=C(C)C5=[N]6C(C(N78)(C)C(CC(N)=O)(C)C(CCC(N)=O)C7=C(C)C1=[N]2[Co+3]648([NH](C(N9C(O%10)C(O)C(OP%11([O-])=O)C%10CO)=O)C%12=C9C=C(C)C(C)=C%12)C#N)C(CC(N)=O)C5(CCC(NCC(O%11)C)=O)C)=O |
Beilstein Registry Number | NA |
Size | 5mg |
Supplier Page | https://www.lgcstandards.com/CA/en/p/TRC-V677005-5MG |