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기본 정보
- CAS
55353-31-6- 표준 SMILES
C/C=C(\CO)C(=O)O[C@H]1[C@H](O)[C@@H](C(=O)OC)O[C@@H]2C[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](OC)[C@H]3O[C@]21O- InChIKey
LOWKANMKNQBRPJ-MRAUHCMASA-N- 분자식
- C23H29N5O11
- 평균 분자량
- 551.509 g/mol
- 단동위원소 질량
- 551.18635675
이름 및 식별자
- 우선 이름
- Herbicidin A
- IUPAC
- 9-{6,10-Anhydro-5-deoxy-8-O-[(2E)-2-(hydroxymethyl)but-2-enoyl]-11-methyl-2-O-methyl-beta-D-arabino-alpha-L-ido-undec-7-ulopyranosefuranosyluronosyl}-9H-purin-6-amine
- 영어명
- Herbicidin A
- 분자식
- C23H29N5O11
- 분자량
- 551.5
이름 및 동의어
HerbicidinHerbicidin A(11R)-11-C-(6-Amino-9H-purin-9-yl)-2,6(11R)-11-C-(6-Amino-9H-purin-9-yl)-2,6:8,11-dianhydro-10-O-methyl-4-O-[(E)-1-oxo-2-(hydroxymethyl)-2-butenyl]-7-deoxy-α-L-ido-D-lyxo-5-undecoulo-5,9-pyranosonic acid methyl esterD-arabino-α-L-ido-7-Undeculo-7,3-pyranose-1,4-furanuronic acid, 1-(6-amino-9H-purin-9-yl)-6,10-anhydro-1,5-dideoxy-2-O-methyl-, methyl ester, 8-[(2E)-2-(hydroxymethyl)-2-butenoate], (7R)-
데이터베이스 식별자
- CAS
55353-31-6- PubChem CID
- 6441694
- DTXSID
DTXSID801317929- ChEMBL
CHEMBL3109448
물성
물리화학적 성질
- 끓는 점
- 826.5 · 826.5±75.0 °C(Predicted)
- 밀도
- 1.78 · 1.78±0.1 g/cm3(Predicted)
- 저장 조건
- -20 °C · Store at -20°C
- 용해도
- DMF: Soluble; DMSO: Soluble; Ethanol: Soluble; Methanol: Soluble
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 10.17 · 10.17±0.70(Predicted)
화학 및 산업
응용 분야
개요Herbicidin A is an adenine nucleoside antibiotic originally isolated from S. saganonensis that exhibits herbicidal activity, particularly against dicotyledonous plants. It prevents rice seed germination (MIC = 6.25 μg/ml) and completely protects young rice plants from X. oryzae-induced leaf blight when applied at 100 ppm. In HEK293 cells, herbicidin A inhibits TNF-α-induced NF-κB activity and induces cytotoxicity (IC50s = 1.8 and 2.7 μM, respectively).
용도Herbicidin A is the major analogue of a family of adenosine nucleosides containing a complex tricyclic saccharide originally isolated from Streptomyces saganonensis, reported by researchers at Sankyo in 1976. Hebicidin A is a potent herbicide with selective activity against dicotyledonous plants. The mode of action and broader pharmacology of herbicidin A has received little attention due to its restricted availability.
공급사15 곳
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ChemeGen 中国18818260767 · [email protected]
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