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Structure

Shikimate-3-phosphate

CAS
63959-45-5
Catalog Number
ACM63959455
Category
Other Products
Molecular Weight
254.13
Molecular Formula
C7H11O8P

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Specification

Synonyms
SHIKIMATE-3-PHOSPHATE;S-3-P;shikimic acid-3-phosphate;(-)-Phosphoric acid [(1R)-3-(carboxylato)-5β,6α-dihydroxy-2-cyclohexene-1α-yl] ester;Phosphoric acid [(3R)-4β,5α-dihydroxy-1-carboxylato-1-cyclohexene-3β-yl] ester
IUPAC Name
(3R,4S,5R)-4,5-dihydroxy-3-phosphonooxycyclohexene-1-carboxylic acid
Canonical SMILES
C1C(C(C(C=C1C(=O)O)OP(=O)(O)O)O)O
InChI Key
QYOJSKGCWNAKGW-PBXRRBTRSA-N
Boiling Point
585.8ºC at 760mmHg
Flash Point
308.1ºC
Density
1.84g/cm³
Appearance
White Solid
Exact Mass
254.01900
H-Bond Acceptor
8
H-Bond Donor
5
Stability
Very Hygroscopic, Moisture Sensitive, Store under Argon and in Freezer
WGK Germany
3
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