CAS RN 117704-25-3
CAS RN 117704-25-3
IUPAC Name:
(1'R,2S,4'S,5S,6R,8'R,10'E,13'S,14'E,16'E,20'R,21'R,24'S)-6-cyclohexyl-21',24'-dihydroxy-12'-{[(2R,4S,6S)-5-{[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-5,11',13',22'-tetramethyl-5,6-dihydro-3',7',19'-trioxaspiro[pyran-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one
Synonyms:
doramectin
Molecular Weight (g/mol):
899.13
Molecular Formula:
C50H74O14
InChi Key:
QLFZZSKTJWDQOS-NJPOTTGESA-N
SMILES:
CO[C@H]1C[C@H](OC2[C@H](C)O[C@H](C[C@@H]2OC)OC2[C@@H](C)\C=C\C=C3/CO[C@@H]4[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]5C[C@@H](C\C=C2/C)O[C@@]2(C5)O[C@H](C5CCCCC5)[C@@H](C)C=C2)[C@]34O)O[C@@H](C)[C@@H]1O
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Thermo Scientific Chemicals Doramectin
CAS: 117704-25-3 Molecular Formula: C50H74O14 Molecular Weight (g/mol): 899.13 InChI Key: QLFZZSKTJWDQOS-NJPOTTGESA-N IUPAC Name: (1'R,2S,4'S,5S,6R,8'R,10'E,13'S,14'E,16'E,20'R,21'R,24'S)-6-cyclohexyl-21',24'-dihydroxy-12'-{[(2R,4S,6S)-5-{[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-5,11',13',22'-tetramethyl-5,6-dihydro-3',7',19'-trioxaspiro[pyran-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one SMILES: CO[C@H]1C[C@H](OC2[C@H](C)O[C@H](C[C@@H]2OC)OC2[C@@H](C)\C=C\C=C3/CO[C@@H]4[C@H](O)C(C)=C[C@@H](C(=O)O[C@H]5C[C@@H](C\C=C2/C)O[C@@]2(C5)O[C@H](C5CCCCC5)[C@@H](C)C=C2)[C@]34O)O[C@@H](C)[C@@H]1O