Spectrum KO000566 for 2-Deoxyribose 5'-phosphate

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
InChI=1S/C5H11O7P/c6-3-1-5(7)12-4(3)2-11-13(8,9)10/h3-7H,1-2H2,(H2,8,9,10)/t3-,4+,5?/m0/s1
KKZFLSZAWCYPOC-PYHARJCCSA-N
C5H11O7P
214.024239322
O=P(O)(O)OCC1OC(O)CC1O

Mass Spectral Metadata

NameValue
KO000566
2016.01.19 (Created 2007.07.07, modified 2011.05.10)
Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
CC BY-NC-SA
KEIO_ID D026
214.02424
API3000, Applied Biosystems
LC-ESI-QQ
MS2
30 V
negative
0.7601979386770331
0.2963793169894711
213
[M-H]-
79.64000938971542 ppm
-0.016963322000009384 Da