2-[[(1R,2S,3R,4S,5S,6R)-2-[carboxymethyl(oxidanyl)phosphoryl]oxy-3,4,5,6-tetrakis(oxidanyl)cyclohexyl]oxy-oxidanyl-phosphoryl]ethanoic acid

Systemtic Name: 2-[[(1R,2S,3R,4S,5S,6R)-2-[carboxymethyl(oxidanyl)phosphoryl]oxy-3,4,5,6-tetrakis(oxidanyl)cyclohexyl]oxy-oxidanyl-phosphoryl]ethanoic acid Openeye Name: 2-[[(1R,2S,3R,4S,5S,6R)-2-[carboxymethyl(hydroxy)phosphoryl]oxy-3,4,5,6-tetrahydroxy-cyclohexoxy]-hydroxy-phosphoryl]acetic acid CAS Name: 2-[[(1R,2S,3R,4S,5S,6R)-2-[carboxymethyl(hydroxy)phosphoryl]oxy-3,4,5,6-tetrahydroxycyclohexyl]oxy-hydroxyphosphoryl]acetic acid IUPAC Name: 2-[[(1R,2S,3R,4S,5S,6R)-2-[carboxymethyl(hydroxy)phosphoryl]oxy-3,4,5,6-tetrahydroxycyclohexyl]oxy-hydroxyphosphoryl]acetic acid Traditional Name: 2-[[(1R,2S,3R,4S,5S,6R)-2-[carboxymethyl(hydroxy)phosphoryl]oxy-3,4,5,6-tetrahydroxy-cyclohexoxy]-hydroxy-phosphoryl]acetic acid Formula: C10H18O14P2 MolecularWeight: 424.189042

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)P(=O)(O)OC1C(C(C(C(C1OP(=O)(CC(=O)O)O)O)O)O)O

Isomeric SMILES

C(C(=O)O)P(=O)(O)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1OP(=O)(CC(=O)O)O)O)O)O)O

InChI

InChI=1S/C10H18O14P2/c11-3(12)1-25(19,20)23-9-7(17)5(15)6(16)8(18)10(9)24-26(21,22)2-4(13)14/h5-10,15-18H,1-2H2,(H,11,12)(H,13,14)(H,19,20)(H,21,22)/t5-,6-,7+,8+,9-,10+/m0/s1