Q105384292
group of stereoisomers with the chemical formula C₅₂H₇₄Cl₂O₁₈
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Q105384292
Summary
Q105384292 is a group of stereoisomers[1].
Key Facts
- Q105384292's instance of is recorded as group of stereoisomers[2].
- Q105384292's canonical SMILES is recorded as O=C(OC1C(O)C(OC)C(OCC2=CC=CCC(O)C(=CC(CC)C(OC3OC(C)(C)C(OC(=O)C(C)C)C(O)C3O)C(=CC(=CCC(OC2=O)C(O)C)C)C)C)OC1C)C=4C(O)=C(Cl)C(O)=C(Cl)C4CC[3].
- Q105384292's InChI is recorded as InChI=1S/C52H74Cl2O18/c1-13-30-22-26(6)33(56)18-16-15-17-31(23-66-51-45(65-12)42(61)44(29(9)67-51)69-49(64)35-32(14-2)36(53)39(58)37(54)38(35)57)48(63)68-34(28(8)55)20-19-25(5)21-27(7)43(30)70-50-41(60)40(59)46(52(10,11)72-50)71-47(62)24(3)4/h15-17,19,21-22,24,28-30,33-34,40-46,50-51,55-61H,13-14,18,20,23H2,1-12H3/b16-15-,25-19-,26-22-,27-21-,31-17-/t28?,29-,30?,33?,34?,40+,41-,42+,43?,44-,45+,46+,50+,51-/m0/s1[4].
- Q105384292's InChIKey is recorded as ZVGNESXIJDCBKN-VPCBDHQDSA-N[5].
- Q105384292's chemical formula is recorded as C₅₂H₇₄Cl₂O₁₈[6].
- Q105384292's subclass of is recorded as macrolides[7].
- Q105384292's PubChem CID is recorded as 101607192[8].
- Q105384292's isomeric SMILES is recorded as CCc1c(Cl)c(O)c(Cl)c(O)c1C(=O)O[C@H]1C@HOC@HC@H[C@@H]1OC@HO[C@H](OC/C2=C/C=C\CC(O)/C(C)=C\C(CC)C(O[C@@H]3OC(C)(C)C@HC@H[C@@H]3O)/C(C)=C\C(C)=C/CC(C(C)O)OC2=">[9].
- Q105384292's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+1056.4252208880002'}[10].
- Q105384292's UniChem compound ID is recorded as 96910519[11].