Chem
J-GLOBAL ID:200907061554456455
Nikkaji number:J378.049J
Lexithromycin
レキシスロマイシン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C38 H70 N2 O13
Molecular formula furigana:
C38-H70-N2-O13
Molecular weight:
762.979
InChI:
InChI=1S/C38H70N2O13/c1-15-26-38(10,46)31(42)21(4)28(39-48-14)19(2)17-36(8,45)33(53-35-29(41)25(40(11)12)16-20(3)49-35)22(5)30(23(6)34(44)51-26)52-27-18-37(9,47-13)32(43)24(7)50-27/h19-27,29-33,35,41-43,45-46H,15-18H2,1-14H3/t19-,20-,21+,22+,23-,24+,25+,26?,27+,29-,30?,31-,32+,33-,35+,36-,37-,38-/m1/s1
InChI key:
HPZGUSZNXKOMCQ-AAFHZFQRSA-N
SMILES:
CCC1OC(=O)[C@H](C)C(O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)C(=NOC)[C@H](C)[C@@H](O)[C@]1(C)O
Systematic name (5):
エリスロマイシン9-(O-メチルオキシム)
9-デオキソ-9-[[メチルオキシ]イミノ]エリトロマイシン
9-(メトキシイミノ)-9-デオキソエリスロマイシン
(3R,4S,5S,6R,7R,9R,11S,12R,13S,14R)-6-{[(2S,3R,4S,6R)-4-(ジメチルアミノ)-3-ヒドロキシ-6-メチルオキサン-2-イル]オキシ}-14-エチル-7,12,13-トリヒドロキシ-4-{[(2R,4R,5S,6S)-5-ヒドロキシ-4-メトキシ-4,6-ジメチルオキサン-2-イル]オキシ}-10-(メトキシイミノ)-3,5,7,9,11,13-ヘキサメチル-1-オキサシクロテトラデカン-2-オン
(3R,4S,5S,6R,7R,9R,11S,12R,13S,14R)-6-{[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-4-{[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy}-10-(methoxyimino)-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecan-2-one
Other name (5):
9-Deoxo-9-[[methyloxy]imino]erythromycin
レキシスロマイシン
Lexithromycin
レキシトロマイシン
9-(Methoxyimino)-9-deoxoerythromycin
CAS registry number:
53066-26-5
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