Emamectin B1B benzoate

HCID 71587503

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기본 정보

CAS: 138511-98-5
표준 SMILES: CN[C@@H]1[C@H](C)O[C@@H](O[C@H]2[C@H](C)O[C@@H](O[C@@H]3/C(C)=C/C[C@@H]4C[C@@H](C[C@]5(C=C[C@H](C)[C@@H](C(C)C)O5)O4)OC(=O)[C@@H]4C=C(C)[C@@H](O)[C@H]5OC/C(=C\C=C\[C@@H]3C)[C@]54O)C[C@@H]2OC)C[C@@H]1OC.O=C(O)c1ccccc1
InChIKey: ISGYOHXFFCGHKT-WVYDVIEQSA-N
분자식: C55H79NO15
평균 분자량: 994.229 g/mol
단동위원소 질량: 993.54497083

우선 이름: Emamectin B1B benzoate
IUPAC: Benzoic acid--[2'S,2a(3)E,4E,5'S,6S,6'R,7S,8E,11R,15S,17aR,20R,20aR,20bS]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-6'-(propan-2-yl)-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-3-O-methyl-4-O-[2,4,6-trideoxy-3-O-methyl-4-(methylamino)-alpha-L-lyxo-hexopyranosyl]-alpha-L-arabino-hexopyranoside (1/1)

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CAS: 138511-98-5
표준 SMILES: CN[C@@H]1[C@H](C)O[C@@H](O[C@H]2[C@H](C)O[C@@H](O[C@@H]3/C(C)=C/C[C@@H]4C[C@@H](C[C@]5(C=C[C@H](C)[C@@H](C(C)C)O5)O4)OC(=O)[C@@H]4C=C(C)[C@@H](O)[C@H]5OC/C(=C\C=C\[C@@H]3C)[C@]54O)C[C@@H]2OC)C[C@@H]1OC.O=C(O)c1ccccc1
InChIKey: ISGYOHXFFCGHKT-WVYDVIEQSA-N
분자식: C55H79NO15
평균 분자량: 994.229 g/mol
단동위원소 질량: 993.54497083

우선 이름: Emamectin B1B benzoate
IUPAC: Benzoic acid--[2'S,2a(3)E,4E,5'S,6S,6'R,7S,8E,11R,15S,17aR,20R,20aR,20bS]-20,20b-dihydroxy-5',6,8,19-tetramethyl-17-oxo-6'-(propan-2-yl)-5',6,6',10,11,14,15,17,17a,20,20a,20b-dodecahydro-2H,7H-spiro[11,15-methanofuro[4,3,2-pq][2,6]benzodioxacyclooctadecine-13,2'-pyran]-7-yl 2,6-dideoxy-3-O-methyl-4-O-[2,4,6-trideoxy-3-O-methyl-4-(methylamino)-alpha-L-lyxo-hexopyranosyl]-alpha-L-arabino-hexopyranoside (1/1)

불러오는 중…