Extrinsic factor

C₆₃H₈₈CoN₁₄O₁₄PCAS 68-19-91355.39 g/mol

Open in Covalent MOL file

Alcohol Alkene Ether Imine Phosphate Secondary amine

Properties

Molecular formula: C₆₃H₈₈CoN₁₄O₁₄P
Molar mass: 1355.39 g/mol
Exact mass: 1354.5674 Da
Melting point: above 300 °C
Boiling point: above 300 °C
logP: 6.22Crippen estimate
Polar surface area: 503.6 Å²
H-bond donors / acceptors: 15 / 21
Rotatable bonds: 26
Stereocentres: R, R, R, R, S, S, R, R, S, S, S, S, Sin SMILES atom order

Identifiers

CAS number

68-19-9

SMILES

CC1=C2N=C(C=C3N=C(C(C)=C4N[C@@](C)([C@@H]5N=C1[C@](C)(CCC(O)=NC[C@@H](C)OP(=O)(O)O[C@H]1C(O)[C@@H]([n+]6c[nH]c7cc(C)c(C)cc76)O[C@@H]1CO)[C@H]5CC(=N)O)[C@@](C)(CC(=N)O)[C@@H]4CCC(=N)[O-])[C@@](C)(CC(=N)O)[C@@H]3CCC(=N)[O-])C(C)(C)[C@@H]2CCC(=N)[O-].[C-]#N.[Co+3]

InChIKey

FDJOLVPMNUYSCM-SYUKHSAKSA-L

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;-1;+3/p-2/t31-,34-,35-,36-,37+,41-,52?,53-,56-,57+,59-,60+,61+,62+;;/m1../s1

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Names and synonyms

114 names · show all

Fresmin
Hemo-b-doze
Hemomin
Hepagon
Hepavis
Hepcovite
Lactobacillus lactis dorner factor
LLD factor
Macrabin
Megalovel
Milbedoce
Nagravon
Normocytin
Pernaemon
Pernaevit
Pernipuron
Plecyamin
Poyamin
Rebramin
Redamina
Redisol
Rhodacryst
Rubesol
Rubramin
Rubripca
Rubrocitol
B-Twelve
B-Twelve ora
Vibalt
Vibisone
Virubra
Vitarubin
Vita-rubra
Vitral
Cobalamin, cyanide
Cobalamin, cyano-
Cobamin
Cykobemin
Factor II (vitamin)
Cobamide, α-5,6-dimethyl-1H-benzimidazolyl-, cyanide
1H-Benzimidazole, 5,6-dimethyl-1-(3-O-phosphono-α-D-ribofuranosyl)-, monoester with cobinamide cyanide, inner salt
Cobamide, cyano-5,6-dimethyl-1H-benzimidazole-
Cyano-5,6-dimethylbenzimidazolylcobamide
5,6-Dimethylbenzimidazolyl-Co-cyanocobamide
Vitamin B12 preparation
Betolvex
Cobalamin, cyano-5,6-dimethylbenzimidazole-
CN-B12
Factor II
Depinar
Cobinamide, cyanide, dihydrogen phosphate (ester), inner salt, 3′-ester with 5,6-dimethyl-1-α-D-ribofuranosyl-1H-benzimidazole
Hepavit
Docivit
Behepan
Bedoz
Berubigen
Antipernicin
Rubramin PC
Millevit
Berubi
Vitasprint B12
Dicopac kit
Betalin 12 crystalline
Crystamine
Bedodeka
Cyredin
Cyomin
SMARTShot B12
NSC 80365
Cromatonbic B12
Regividerm cream
Rheumazin
Nascobal
Rubivamine
Apikobal
Eligen B12
Optovite B12
Castle's factor
Castle's extrinsic factor
Castle's gastric factor
Vitamin B12
Sytobex
Anacobin
Betalin 12
Betaline 12
Byladoce
Cobalin
Cotel
Covit
Crystamin
Cyano-B12
Cyanocobalamin
Cyanocobalamine
Cycolamin
Cykobeminet
Cytacon
Cytamen
Cytobion
5,6-Dimethylbenzimidazolyl cyanocobamide
Dobetin
Docemine
Docibin
Docigram
Dodecabee
Dodecavite
Dodex
Ducobee
Duodecibin
Embiol
Emociclina
Eritrone
Erycytol
Erythrotin
Euhaemon

Work with Extrinsic factor

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Methylcobalamin13422-55-494 % similar Hydroxocobalamin13422-51-091 % similar Acetatocobalamin22465-48-190 % similar Hydroxocobalamin hydrochloride58288-50-990 % similar Coenzyme B1213870-90-180 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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