기본 정보
- CAS
9012-54-8- 표준 SMILES
OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)O[C@@H]3CO)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O- InChIKey
FYGDTMLNYKFZSV-CSHPIKHBSA-N- 분자식
- C18H32O16
- 평균 분자량
- 504.4 g/mol
- 단동위원소 질량
- 504.16903493
개요
Beta-cellotriose is a cellotriose with a beta-configuration at the anomeric position.
이름 및 식별자
- 우선 이름
- Cellulase
- IUPAC
- (2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
- 현지명
- 셀룰라아제
- 영어명
- cellulase
- 분자식
- NULL
- 분자량
- 0
이름 및 동의어
Cellulase9012-54-8CellulysinEndoglucanaseEndo-1,4-beta-GlucanaseGlyTouCan:G14338VKCellulase, aspergillus nigerCellulase, trichoderma viridebeta 1,4 Glucan 4 Glucanohydrolase(2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol1,4-(1,3;1,4)-beta-D-Glucan-4-glucanohydrolase(2S,3R,4S,5S,6R)-2-((2R,3S,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-((2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl)oxyoxan-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol
이름 더 보기
셀룰라아제셀룰라제셀룰라아제(CELLULASE)셀룰레이스셀룰라즈cellulase enzymeAcid cellulaseProtease EnzymeCelluaseMEICELASEDefinitionCelluclast 1.5LCellulose enzymeCELLULASE ONOZUKA R-10
물성
구조 계산 물성
- XLogP
- -6.9
- 극성 표면적
- 269 Ų
- 수소 결합 공여자 수
- 11
- 수소 결합 수용자 수
- 16
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 641
실험 및 물리화학적 성질
Chemical ClassesBiological Agents -> Enzymes
DrugsPharmaceuticals -> Listed in ZINC15
Physical DescriptionSolid; [IUCLID]
물리화학적 성질
- 밀도
- 1.2 g/mL · 1.2 g/mL at 25 °C
- 증기압
- 0.004 Pa · 0.004Pa at 25℃
- 저장 조건
- 2 · 2-8°C
- 용해도
- 5 mg/mL · 탈이온수: 용해성 5.0mg/mL(멸균; 0.15% 폴리헥사메틸렌 비구아나이드(PHMB) 존재 시)
- 물리적 상태
- 가루
- 색상
- 하얀색
- 생물학적 소스
- fungus (Trichoderma viride)
- 수용성
- 찬물에 용해됩니다.
- Specific Activity
- 3 · 3-10units/mg solid
- 화장품 원료 기능
- 각질용해제구강 관리점도 조절
- LogP
- -1.3 at · -1.3 at 20℃
- EPA
- Cellulase (9012-54-8)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H334: May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]
P233, P260, P271, P284, P304+P340, P342+P316, P403, and P501 (click each P-code to see the statement)
This chemical does not meet GHS hazard criteria for 0.6% (11 of 1889) of reports.
Danger
H334 (99.4%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]
유해성 정보
Regulatory Information
Chemical: Cellulase
Hazard Traits - Respiratory Toxicity
Hazard Traits - Respiratory Toxicity
Cellulase is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cellulase are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
XU - indicates a substance exempt from reporting under the Chemical Data Reporting Rule, (40 CFR 711).
REACH registered substance: Cellulase (EC: 232-734-4)
Other Safety InformationIMAP assessments - Cellulase: Environment tier I assessment
Hazards SummaryMay cause respiratory sensitization; [IUCLID] May cause irritation and respiratory sensitization; [Sigma-Aldrich MSDS] Danger of airway sensitization; [MAK] See Fungal cellulase.
EPA Safer ChemicalChemical: Cellulase
Hazard Classes and Categories
Resp. Sens. 1A (99.4%)
Respiratory sensitisation - category 1
Resp. Sens. 1
독성 정보
화학 및 산업
용도 및 제조
UsesIn enzyme preparations used to make instant coffee, bread, fruit juice, and wine; [JECFA] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]
U.S. Production2023: 26 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesNot Known or Reasonably Ascertainable
Household Products
Cosmetics product ingredient: Cellulases with the exception of those specified elsewhere in EC Annex VI (Cellulase (9012-54-8)))
Information on 104 consumer products that contain Cellulase in the following categories is provided:
Use Classification
EPA Safer Chemical Functional Use Classes -> Enzymes and Enzyme Stabilizers
Safer Chemical Classes -> Yellow triangle - The chemical has met Safer Choice Criteria for its functional ingredient-class, but has some hazard profile issues
General Manufacturing Information
Not Known or Reasonably Ascertainable
Cellulase: ACTIVE
응용 분야
용도Cellulase has been used to degrade cello-oligosaccharides into glucose and to study the biodegradability of bioabsorbable bacterial cellulose (BBC) material. It has been used in a study to assess the differential regulation of the cellulase transcription factors XYR1, ACE2, and ACE. It is also applied in the biodegradation of paper products such as foolscap paper, filter paper, newspaper and office paper as well as microcrystalline cellulose. It is added to detergents to improve cleansing properties.
일반 설명This product has been enhanced for energy efficiency and waste prevention when used in cellulosic ethanol research.
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…