Chem
J-GLOBAL ID：200907018237246949   Nikkaji number：J2.762.431F

Hydrogenobyrinate diamide

ヒドロゲノビリン酸ジアミド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C45H62N6O12
Molecular formula furigana： C45-H62-N6-O12
Molecular weight： 879.021
InChI： InChI=1S/C45H62N6O12/c1-21-36-24(10-13-32(56)57)41(3,4)28(49-36)18-27-23(9-12-31(54)55)43(6,19-29(46)52)39(48-27)22(2)37-25(11-14-33(58)59)44(7,20-30(47)53)45(8,51-37)40-26(17-35(62)63)42(5,38(21)50-40)16-15-34(60)61/h18,23-26,40,50H,9-17,19-20H2,1-8H3,(H2,46,52)(H2,47,53)(H,54,55)(H,56,57)(H,58,59)(H,60,61)(H,62,63)/b28-18-,38-21-,39-22?/t23-,24-,25-,26+,40?,42-,43+,44+,45+/m1/s1
InChI key： BYLRAQWTUVCQLV-AOEYPXNXSA-N
SMILES： C/C/1=C\2/NC([C@H](CC(=O)O)[C@@]2(C)CCC(=O)O)[C@]2(C)N=C([C@@H](CCC(=O)O)[C@]2(C)CC(=O)N)C(=C2N=C(/C=C/3\N=C1[C@@H](CCC(=O)O)C3(C)C)[C@@H](CCC(=O)O)[C@]2(C)CC(=O)N)C
Systematic name  (3)：
  • (1R,2S,3S,7S,8S,13S,17R,18R)-2,7-ジ(カルバモイルメチル)-18-(カルボキシメチル)-1,2,5,7,12,12,15,17-オクタメチルコリーン-3,8,13,17-テトラプロパン酸
  • 3-[(1R,3R,4R,5Z,8S,10Z,13S,14S,18S,19S)-14,19-ビス(カルバモイルメチル)-8,13,18-トリス(2-カルボキシエチル)-3-(カルボキシメチル)-1,4,6,9,9,14,16,19-オクタメチル-20,21,22,23-テトラアザペンタシクロ[15.2.1.12,5.17,10.112,15]トリコサ-5,7(22),10,12(21),15,17(20)-ヘキサエン-4-イル]プロパン酸
  • 3-[(1R,3R,4R,5Z,8S,10Z,13S,14S,18S,19S)-14,19-bis(carbamoylmethyl)-8,13,18-tris(2-carboxyethyl)-3-(carboxymethyl)-1,4,6,9,9,14,16,19-octamethyl-20,21,22,23-tetraazapentacyclo[15.2.1.12,5.17,10.112,15]tricosa-5,7(22),10,12(21),15,17(20)-hexaen-4-yl]propanoic acid
Other name (5)：
  • (1R,2S,3S,7S,8S,13S,17R,18R)-2,7-Di(carbamoylmethyl)-18-(carboxymethyl)-1,2,5,7,12,12,15,17-octamethylcorrin-3,8,13,17-tetrapropanoic acid
  • Hydrogenobyrinate a,c diamide
  • Hydrogenobyrinate diamide
  • Hydrogenobyrinic acid a,c-diamide
  • ヒドロゲノビリン酸ジアミド
KEGG COMPOUND： C06503
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM