아베르멕틴

Avermectin

HCID 6858006CAS 73989-17-0
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CCC(C)[C@H]1O[C@]2(C=C[C@@H]1C)C[C@@H]1C[C@@H](C/C=C(\C)[C@@H](O[C@H]3C[C@H](OC)[C@@H](O[C@H]4C[C@H](OC)[C@@H](O)[C@H](C)O4)[C@H](C)O3)[C@@H](C)/C=C/C=C3\CO[C@@H]4[C@H](O)C(C)=C[C@@H](C(=O)O1)[C@]34O)O2
InChIKey
RRZXIRBKKLTSOM-VDYLCOMISA-N
분자식
C48H72O14
평균 분자량
873.1 g/mol
단동위원소 질량
872.49220697

이름 및 식별자

우선 이름
Avermectin
IUPAC
(1'R,2R,3S,4'S,6S,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-2-butan-2-yl-21',24'-dihydroxy-12'-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one
현지명
아베르멕틴
영어명
AVERMECTIN
분자식
C44H66O14
분자량
818.98644

이름 및 동의어

Avermectin73989-17-0DTXSID3032678(1'R,2R,3S,4'S,6S,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-2-butan-2-yl-21',24'-dihydroxy-12'-((2R,4S,5S,6S)-5-((2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl)oxy-3,11',13',22'-tetramethylspiro(2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo(15.6.1.14,8.020,24)pentacosa-10,14,16,22-tetraene)-2'-one(1'R,2R,3S,4'S,6S,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-2-butan-2-yl-21',24'-dihydroxy-12'-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-oneRefChem:916538CHEBI:50344MLS006011596(1'R,2S,4'S,5S,6R,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-6-(butan-2-yl)-21',24'-dihydroxy-12'-{[(2R,4S,5S,6S)-5-{[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-Abamectin/AvermectinCHEMBL80025SCHEMBL13417423
이름 더 보기
아베르멕틴SongxianguangAverMectin FDAAvermectin (type unspecified)
RRZXIRBKKLTSOM-VDYLCOMISA-NNP500LMPK04000024STK801959AKOS005622621CCG-270547SMR0047033692-yl]oxy}-5,11',13',22'-tetramethyl-5,6-dihydro-3',7',1

데이터베이스 식별자

CAS
73989-17-0
PubChem CID
6858006
ChEMBL
CHEMBL80025

물성

구조 계산 물성

XLogP
3.8
극성 표면적
170 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
14
회전 가능 결합 수
8
무거운 원자 수
62

안전 및 규제

안전 데이터

독성
dni-uns 45 mg/L JANTAJ 37,253,1984

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 4건

Agents that kill parasitic worms. They are used therapeutically in the treatment of HELMINTHIASIS in man and animal.

Substances that are destructive to protozoans.

Pesticides designed to control insects that are harmful to man. The insects may be directly harmful, as those acting as disease vectors, or indirectly harmful, as destroyers of crops, food products, or textile fabrics.

Drugs that bind to and activate excitatory amino acid receptors.

공급사16 곳

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
LGM Pharma1-(800)-881-8210 · [email protected]
Protheragen-ING+86-15618352007 · [email protected]
湖北扬信医药科技有限公司0714-3999001 19171453112 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]

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