Chem
J-GLOBAL ID:201207061371257572   Nikkaji number:J3.023.152J

Coenzyme F420

補酵素F420
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: C29H36N5O18P
Molecular formula furigana: C29-H36-N5-O18-P
Molecular weight: 773.598
InChI: InChI=1S/C29H36N5O18P/c1-12(25(42)31-17(28(46)47)4-6-21(38)30-16(27(44)45)5-7-22(39)40)52-53(49,50)51-11-20(37)23(41)19(36)10-34-18-9-14(35)3-2-13(18)8-15-24(34)32-29(48)33-26(15)43/h2-3,8-9,12,16-17,19-20,23,35-37,41H,4-7,10-11H2,1H3,(H,30,38)(H,31,42)(H,39,40)(H,44,45)(H,46,47)(H,49,50)(H,33,43,48)/t12-,16-,17-,19-,20+,23-/m0/s1
InChI key: GEHSZWRGPHDXJO-NALJQGANSA-N
SMILES: C[C@H](OP(=O)(O)OC[C@@H](O)[C@@H](O)[C@@H](O)Cn1c2cc(O)ccc2cc2c1nc(=O)[nH]c2=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O
Systematic name  (3):
  • 1-デオキシ-1-[(2,3,4,10-テトラヒドロ-8-ヒドロキシ-2,4-ジオキソピリミド[4,5-b]キノリン)-10-イル]-D-リビトール5-りん酸(1S,4S,9S)-4,9,11-トリカルボキシ-1-メチル-2,7-ジオキソ-3,8-ジアザウンデカン-1-イル
  • (2S)-2-[(4S)-4-カルボキシ-4-[(2S)-2-{[ヒドロキシ({[(2R,3S,4S)-2,3,4-トリヒドロキシ-5-{8-ヒドロキシ-2,4-ジオキソ-2H,3H,4H,10H-ピリミド[4,5-b]キノリン-10-イル}ペンチル]オキシ})ホスホリル]オキシ}プロパンアミド]ブタンアミド]ペンタン二酸
  • (2S)-2-[(4S)-4-carboxy-4-[(2S)-2-{[hydroxy({[(2R,3S,4S)-2,3,4-trihydroxy-5-{8-hydroxy-2,4-dioxo-2H,3H,4H,10H-pyrimido[4,5-b]quinolin-10-yl}pentyl]oxy})phosphoryl]oxy}propanamido]butanamido]pentanedioic acid
Other name (5):
  • 1-Deoxy-1-[(2,3,4,10-tetrahydro-8-hydroxy-2,4-dioxopyrimido[4,5-b]quinoline)-10-yl]-D-ribitol 5-phosphoric acid (1S,4S,9S)-4,9,11-tricarboxy-1-methyl-2,7-dioxo-3,8-diazaundecane-1-yl ester
  • 補酵素F420
  • Coenzyme F420
  • 補酵素F420
  • Coenzyme F420
CAS registry number: 64885-97-8
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