디히드로니코틴아미드포마이신디뉴클레오티드

Dihydronicotinamide formycin dinucleotide

HCID 928CAS 74927-11-0

기본 정보

표준 SMILES
NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)C=CC1
InChIKey
BOPGDPNILDQYTO-UHFFFAOYSA-N
분자식
C21H29N7O14P2
평균 분자량
665.4 g/mol
단동위원소 질량
665.12477187

개요

NADH is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).

이름 및 식별자

우선 이름
Dihydronicotinamide formycin dinucleotide
IUPAC
[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate
현지명
디히드로니코틴아미드포마이신디뉴클레오티드
영어명
dihydronicotinamide formycin dinucleotide
분자식
C21H29N7O14P2
분자량
665.45

이름 및 동의어

Dihydronicotinamide formycin dinucleotideNFDH74927-11-0[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate((5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl)methoxy-hydroxyphosphoryl) (5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl)methyl hydrogen phosphateRefChem:133894Dihydronicotinamide-adenine dinucleotideCERAPP_26258SCHEMBL12253377SCHEMBL29740660DTXSID20861594dihydronicotinamide adenine dinu-cleotide
이름 더 보기
디히드로니코틴아미드포마이신디뉴클레오티드D-Ribitol, 1-C-(7-amino-1H-pyrazolo[4,3-d]pyrimidin-3-yl)-1,4-anhydro-, 5-(trihydrogen diphosphate), P'→5'-ester with 1,4-dihydro-1-β-D-ribofuranosyl-3-pyridinecarboxamide, (1S)- (9CI)
NS00041065[5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [5-(3-carbamoylpyridin-1(4H)-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen diphosphateD-Ribitol, 1-C-(7-amino-1H-pyrazolo(4,3-d)pyrimidin-3-yl)-1,4-anhydro-, 5-(trihydrogen diphosphate), 5-5'-ester with 1,4-dihydro-1-beta-D-ribofuranosyl-3-pyridinecarboxamide, (S)-

데이터베이스 식별자

CAS
74927-11-0
PubChem CID
928
DTXSID
DTXSID20861594

물성

구조 계산 물성

XLogP
-5.7
극성 표면적
318 Ų
수소 결합 공여자 수
8
수소 결합 수용자 수
19
회전 가능 결합 수
11
무거운 원자 수
44

물리화학적 성질

끓는 점
1101.3 · 1101.3±75.0 °C(Predicted)
밀도
1.868 · 1.868±0.06 g/cm3(Predicted)
산도 계수 (pKa)
1.13 · 1.13±0.50(Predicted)

관련 반응

5건

연결된 노트

불러오는 중…