9H-Purin-6-amine, 9-[(2ξ)-5-O-[[[[(3S)-4-[[3-[[2-(acetylthio)ethyl]amino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]-3-O-phosphono-β-D-threo-pen tofuranosyl]-, ion(4-)

Molecular FormulaC₂₃H₃₄N₇O₁₇P₃S
Average mass Da
Monoisotopic mass Da
ChemSpider ID5292362

- Charge
- 4 of 5 defined stereocentres

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

9H-Purin-6-amine, 9-[(2ξ)-5-O-[[[[(3S)-4-[[3-[[2-(acetylthio)ethyl]amino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]-3-O-phosphono-β-D-threo-pen tofuranosyl]-, ion(4-) [ACD/Index Name]

Acetyl coenzyme A

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

nchembio811-comp8 [DBID]

nchembio875-comp7 [DBID]

Predicted - ACD/Labs
Predicted - ChemAxon

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

No predicted properties have been calculated for this compound.

Density:
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Index of Refraction:
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#H bond acceptors:
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ACD/LogP:
ACD/LogD (pH 5.5):
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ACD/LogD (pH 7.4):
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9H-Purin-6-amine, 9-[(2ξ)-5-O-[[[[(3S)-4-[[3-[[2-(acetylthio)ethyl]amino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]-3-O-phosphono-β-D-threo-pen tofuranosyl]-, ion(4-)

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