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1-aminochloranuidyl-2-fluoroethane;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-2,3-dihydroxy-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-4-carboxylic acid;(2S,3R,4S,5S,6R)-6-(4-bromophenyl)-4-[(2-fluoroethylamino)methyl]-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-2,3-diol;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-N-(2-fluoroethyl)-2,3-dihydroxy-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-4-carboxamide;bis(4-[(2S,3R,4S,5S,6R)-4-[(2-fluoroethylamino)methyl]-2,3-dihydroxy-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-trien-6-yl]benzonitrile)

HCID 159690834
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기본 정보

InChIKey
QPPSWJFTJDHOHW-DNSZJDRDSA-N
분자식
C132H128Br3ClF5N12O23-
평균 분자량
2,620.6 g/mol

이름 및 식별자

우선 이름
1-aminochloranuidyl-2-fluoroethane;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-2,3-dihydroxy-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-4-carboxylic acid;(2S,3R,4S,5S,6R)-6-(4-bromophenyl)-4-[(2-fluoroethylamino)methyl]-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-2,3-diol;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-N-(2-fluoroethyl)-2,3-dihydroxy-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-4-carboxamide;bis(4-[(2S,3R,4S,5S,6R)-4-[(2-fluoroethylamino)methyl]-2,3-dihydroxy-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-trien-6-yl]benzonitrile)
IUPAC
1-aminochloranuidyl-2-fluoroethane;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-2,3-dihydroxy-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-4-carboxylic acid;(2S,3R,4S,5S,6R)-6-(4-bromophenyl)-4-[(2-fluoroethylamino)methyl]-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-2,3-diol;(2S,3R,4R,5S,6R)-6-(4-bromophenyl)-N-(2-fluoroethyl)-2,3-dihydroxy-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-triene-4-carboxamide;bis(4-[(2S,3R,4S,5S,6R)-4-[(2-fluoroethylamino)methyl]-2,3-dihydroxy-12-methoxy-5-phenyl-7-oxa-10-azatricyclo[6.4.0.02,6]dodeca-1(12),8,10-trien-6-yl]benzonitrile)
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데이터베이스 식별자

PubChem CID
159690834

물성

구조 계산 물성보충 중

극성 표면적
535 Ų
수소 결합 공여자 수
16
수소 결합 수용자 수
40
회전 가능 결합 수
32
무거운 원자 수
176
형식 전하
-1
복잡도
2,970

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