shikimic acid-3-phosphate

4,5-dihydroxy-3-phosphonooxycyclohexene-1-carboxylic acid

CAS: 63959-45-5

Molecular Formula	`C7H11O8P`
Molecular Weight	254.13 g/mol
LogP	-2.8
Topological Polar Surface Area	145.0 A2
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	8
Rotatable Bonds	3
Exact Mass	254.01915
Heavy Atoms	16
Complexity	357.0

Chemical Identifiers

CAS Number	63959-45-5
SMILES	`C1C(C(C(C=C1C(=O)O)OP(=O)(O)O)O)O`
InChIKey	`QYOJSKGCWNAKGW-UHFFFAOYSA-N`

📖 Product Overview

shikimic acid-3-phosphate (CAS: 63959-45-5) is a chemical compound with molecular formula C7H11O8P and molecular weight 254.13 g/mol. Its IUPAC systematic name is 4,5-dihydroxy-3-phosphonooxycyclohexene-1-carboxylic acid. LogP -2.8 Topological Polar Surface Area 145.0 A2 Hydrogen Bond Donors 5 Hydrogen Bond Acceptors 8 Rotatable Bonds 3 Exact Mass 254.01915 Heavy Atoms 16 Complexity 357.0 InChI Key: QYOJSKGCWNAKGW-UHFFFAOYSA-N. SMILES: C1C(C(C(C=C1C(=O)O)OP(=O)(O)O)O)O.

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