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(11S,17S,20S,23S,27S,39S,42R,63R,66S)-66-(aminochloranuidylmethyl)-47-fluoro-20-[(1R)-1-hydroxyethyl]-17-[(4-methoxyphenyl)methyl]-11,63-dimethyl-28-oxa-1,15,18,21,24,31,51,65,68-nonazanonacyclo[37.18.11.23,6.124,42.133,37.144,51.011,15.023,27.045,50]triheptaconta-3(73),4,6(72),33,35,37(71),44(69),45(50),46,48-decaene-10,16,19,22,30,40,58,61,64,67,70-undecone;5-carboxypentyl(trimethyl)azanium;[8-[(11S,17S,20S,23S,27S,39S,42R,63R,66R)-47-fluoro-20-[(1R)-1-hydroxyethyl]-17-[(4-methoxyphenyl)methyl]-11,63-dimethyl-10,16,19,22,30,40,58,61,64,67,70-undecaoxo-28-oxa-1,15,18,21,24,31,51,65,68-nonazanonacyclo[37.18.11.23,6.124,42.133,37.144,51.011,15.023,27.045,50]triheptaconta-3(73),4,6(72),33,35,37(71),44(69),45(50),46,48-decaen-66-yl]-6-oxooctyl]-trimethylazanium;2,2,2-trifluoroacetate

HCID 157265175
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기본 정보

InChIKey
FJWXPDBRQANDMS-JIERMVCLSA-O
분자식
C173H229ClF5N21O33
평균 분자량
3,261 g/mol

이름 및 식별자

우선 이름
(11S,17S,20S,23S,27S,39S,42R,63R,66S)-66-(aminochloranuidylmethyl)-47-fluoro-20-[(1R)-1-hydroxyethyl]-17-[(4-methoxyphenyl)methyl]-11,63-dimethyl-28-oxa-1,15,18,21,24,31,51,65,68-nonazanonacyclo[37.18.11.23,6.124,42.133,37.144,51.011,15.023,27.045,50]triheptaconta-3(73),4,6(72),33,35,37(71),44(69),45(50),46,48-decaene-10,16,19,22,30,40,58,61,64,67,70-undecone;5-carboxypentyl(trimethyl)azanium;[8-[(11S,17S,20S,23S,27S,39S,42R,63R,66R)-47-fluoro-20-[(1R)-1-hydroxyethyl]-17-[(4-methoxyphenyl)methyl]-11,63-dimethyl-10,16,19,22,30,40,58,61,64,67,70-undecaoxo-28-oxa-1,15,18,21,24,31,51,65,68-nonazanonacyclo[37.18.11.23,6.124,42.133,37.144,51.011,15.023,27.045,50]triheptaconta-3(73),4,6(72),33,35,37(71),44(69),45(50),46,48-decaen-66-yl]-6-oxooctyl]-trimethylazanium;2,2,2-trifluoroacetate
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IUPAC
(11S,17S,20S,23S,27S,39S,42R,63R,66S)-66-(aminochloranuidylmethyl)-47-fluoro-20-[(1R)-1-hydroxyethyl]-17-[(4-methoxyphenyl)methyl]-11,63-dimethyl-28-oxa-1,15,18,21,24,31,51,65,68-nonazanonacyclo[37.18.11.23,6.124,42.133,37.144,51.011,15.023,27.045,50]triheptaconta-3(73),4,6(72),33,35,37(71),44(69),45(50),46,48-decaene-10,16,19,22,30,40,58,61,64,67,70-undecone;5-carboxypentyl(trimethyl)azanium;[8-[(11S,17S,20S,23S,27S,39S,42R,63R,66R)-47-fluoro-20-[(1R)-1-hydroxyethyl]-17-[(4-methoxyphenyl)methyl]-11,63-dimethyl-10,16,19,22,30,40,58,61,64,67,70-undecaoxo-28-oxa-1,15,18,21,24,31,51,65,68-nonazanonacyclo[37.18.11.23,6.124,42.133,37.144,51.011,15.023,27.045,50]triheptaconta-3(73),4,6(72),33,35,37(71),44(69),45(50),46,48-decaen-66-yl]-6-oxooctyl]-trimethylazanium;2,2,2-trifluoroacetate

데이터베이스 식별자

PubChem CID
157265175

물성

구조 계산 물성보충 중

극성 표면적
723 Ų
수소 결합 공여자 수
14
수소 결합 수용자 수
40
회전 가능 결합 수
24
무거운 원자 수
233
형식 전하
0
복잡도
6,380

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