MassBank of North America

Spectrum PR010052 for D-Ribose 5-phosphate

Rating: ★★★☆☆

Originally submitted to the MassBank High Quality Mass Spectral Database as MassBank

SPLASH:
splash10-00di-9532000000-693524b08b2ccd6179c5
Submitter:
RIKEN Plant Science Center Team

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.

Kingdom
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Organic compounds
- Superclass
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  Organic oxygen compounds
  - Class
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    Organooxygen compounds
    - Subclass
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      Carbohydrates and carbohydrate conjugates
      - Intermediate Parent 1
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        Monosaccharides
        Intermediate Parent 2
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        Pentoses

Compound Metadata

Name	Value
compound class Create New Query Add to Query	Natural Product
InChI Create New Query Add to Query	InChI=1S/C5H11O8P/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5?/m1/s1
InChIKey Create New Query Add to Query	KTVPXOYAKDPRHY-SOOFDHNKSA-N
molecular formula Create New Query Add to Query	C5H11O8P
total exact mass Create New Query Add to Query	230.019153942
SMILES Create New Query Add to Query	O=P(O)(O)OCC1OC(O)C(O)C1O

External Identifier	Value
cas Create New Query Add to Query	18265-46-8

Mass Spectral Metadata

Name	Value
accession Create New Query Add to Query	PR010052
date Create New Query Add to Query	2016.01.19 (Created 2006.12.21, modified 2011.05.06)
author Create New Query Add to Query	Kusano M, Fukushima A, Plant Science Center, RIKEN.
license Create New Query Add to Query	CC BY-SA
exact mass Create New Query Add to Query	230.01915
instrument Create New Query Add to Query	Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies
instrument type Create New Query Add to Query	GC-EI-TOF
ms level Create New Query Add to Query	MS1
retention index Create New Query Add to Query	2085.6
retention time Create New Query Add to Query	499.558 sec
derivatization formula Create New Query Add to Query	C21H54NO8PSi5
derivatization mass Create New Query Add to Query	619.24334
derivatization type Create New Query Add to Query	5 TMS; 1 MEOX
whole Create New Query Add to Query	ChromaTOF ver. 2.32 (Leco)
ionization mode Create New Query Add to Query	positive
spectral entropy Create New Query Add to Query	3.4880583607964057
normalized entropy Create New Query Add to Query	0.6558818463731305