Deoxythymidine triphosphate (HCID 1151)

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기본 정보

표준 SMILES: Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O
InChIKey: NHVNXKFIZYSCEB-UHFFFAOYSA-N
분자식: C10H17N2O14P3
평균 분자량: 482.17 g/mol
단동위원소 질량: 481.98926421

개요

thymidine triphosphate has been reported in Homo sapiens with data available.

이름 및 식별자

우선 이름: Deoxythymidine triphosphate
IUPAC: [hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate

이름 및 동의어

Deoxythymidine triphosphate[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate(hydroxy-((3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl)methoxy)phosphoryl) phosphono hydrogen phosphateRefChem:10831561-[2-deoxy-5-o-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]-5-methylpyrimidine-2,4(1h,3h)-dione27821-54-1SCHEMBL21275938DTXSID70861903{[hydroxy({[hydroxy({[(2R,3S,5R)-3-hydroxy-5-(4-hydroxy-5-methyl-2-oxo-1,2-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy})phosphoryl]oxy})phosphoryl]oxy}phosphonic acidDB-085696[Hydroxy-[[(2R,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate154117-14-3

데이터베이스 식별자

PubChem CID: 1151
DTXSID: DTXSID70861903

물성

구조 계산 물성

XLogP: -5
극성 표면적: 239 Å²
수소 결합 공여자 수: 6
수소 결합 수용자 수: 14
회전 가능 결합 수: 8
무거운 원자 수: 29
형식 전하: 0
복잡도: 853

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