(2S,3R,4R,5S,6R)-2-[4-chloranyl-5-[(4-ethylphenyl)methyl]-2-(2-oxidanylpropoxymethyl)phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol

Systemtic Name: (2S,3R,4R,5S,6R)-2-[4-chloranyl-5-[(4-ethylphenyl)methyl]-2-(2-oxidanylpropoxymethyl)phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol Openeye Name: (2S,3R,4R,5S,6R)-2-[4-chloro-5-[(4-ethylphenyl)methyl]-2-(2-hydroxypropoxymethyl)phenyl]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: (2S,3R,4R,5S,6R)-2-[4-chloro-5-[(4-ethylphenyl)methyl]-2-(2-hydroxypropoxymethyl)phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol IUPAC Name: (2S,3R,4R,5S,6R)-2-[4-chloro-5-[(4-ethylphenyl)methyl]-2-(2-hydroxypropoxymethyl)phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: (2S,3R,4R,5S,6R)-2-[4-chloro-5-(4-ethylbenzyl)-2-(2-hydroxypropoxymethyl)phenyl]-6-methylol-tetrahydropyran-3,4,5-triol Formula: C25H33ClO7 MolecularWeight: 480.97832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=C(C=C(C(=C2)C3C(C(C(C(O3)CO)O)O)O)COCC(C)O)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=C(C=C(C(=C2)[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)COCC(C)O)Cl

InChI

InChI=1S/C25H33ClO7/c1-3-15-4-6-16(7-5-15)8-17-9-19(18(10-20(17)26)13-32-12-14(2)28)25-24(31)23(30)22(29)21(11-27)33-25/h4-7,9-10,14,21-25,27-31H,3,8,11-13H2,1-2H3/t14?,21-,22-,23+,24-,25+/m1/s1