기본 정보
- CAS
53956-04-0- 표준 SMILES
CC1(C)[C@@H](O[C@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)CC[C@]2(C)[C@H]3C(=O)C=C4[C@@H]5C[C@@](C)(C(=O)O)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12.N- InChIKey
ILRKKHJEINIICQ-OOFFSTKBSA-N- 분자식
- C42H62O16.H3N
- 평균 분자량
- 840 g/mol
- 단동위원소 질량
- 839.43033499
개요
Monoammonium glycyrrhizinate is an organic molecular entity.
이름 및 식별자
- 우선 이름
- Ammonium Glycyrrhizate
- IUPAC
- (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid;azane
- 현지명
- 글리직 산 암모늄 염
- 영어명
- Glycyrrhizic acid ammonium salt
- 분자식
- C42H65NO16
- 분자량
- 839.97
이름 및 동의어
AMMONIUM GLYCYRRHIZINATEAmmonium glycyrrhizate53956-04-0Monoammonium glycyrrhizinateGlycamilGlycyrramMonoammonium glycyrrhizateAmmoniated glycyrrhizinGlycyrrhizic acid, ammonium saltGlycyrrhizic acid, monoammonium saltFEMA No. 2528CCRIS 1897
이름 더 보기
글리직산암모늄염글리직산암모늄염암모늄글리시리제이트MagnasweetMonoammonium Glycyrrhizinate Smonoammoniumglycyrrhizateglycyrrhizin monoammonium saltGLYCYRRHIZINATE MONOAMMONIUM SALTGLYCYRRHIZIC ACID MONOAMMONIUM SALTicorice)
Glycyrrhizinic acid, ammonium salt (1:1)NSC 2800EINECS 258-887-7UNII-3VRD35U26C3VRD35U26CGlycyrrhizin, ammoniated (Glycyrrhiza spp.)Glycyron No.1 (TN)Ammonium glycyrrhizate (NF)
데이터베이스 식별자
물성
구조 계산 물성
- 극성 표면적
- 268 Ų
- 수소 결합 공여자 수
- 9
- 수소 결합 수용자 수
- 17
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 59
- 형식 전하
- 0
- 복잡도
- 1,730
실험 및 물리화학적 성질
Cosmetics
Cosmetic ingredients (Ammonium Glycyrrhizate) -> CIR (Cosmetic Ingredient Review)
Skin conditioning
FragrancesFragrance Ingredient (Glycyrrhizin, ammoniated (Glycyrrhiza spp.)) -> IFRA transparency List
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Flavoring AgentsEU Flavoring substances
Animal DrugsPharmaceuticals -> UK Veterinary Medicines Directorate List
Collision Cross Section284.9 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
물리화학적 성질
- 녹는점
- 200 °C · >200°C (dec.)
- 끓는 점
- 768.56 °C · 768.56°C (rough estimate)
- 밀도
- 1.1846 · 1.1846 (rough estimate)
- FEMA
- 2528 · 2528 | GLYCYRRHIZIN, AMMONIATED (GLYCYRRHIZA SPP.)
- 굴절률
- 49 ° · 49 ° (C=1.5, EtOH)
- 저장 조건
- 2 · 2-8°C
- 용해도
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 36.4% (98 of 269) of reports.
Warning
H319 (62.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 269 reports by companies from 4 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: .alpha.-D-Glucopyranosiduronic acid, (3.beta.,20.beta.)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-.beta.-D-glucopyranuronosyl-, monoammonium salt
Regulation (EC) No 1831/2003 (amended)
REACH registered substance: Ammonium glycyrrhizate (EC: 258-887-7)
.alpha.-D-Glucopyranosiduronic acid, (3.beta.,20.beta.)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-.beta.-D-glucopyranuronosyl-, monoammonium salt: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesEye Irrit. 2 (62.8%)
독성 정보
Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
안전 데이터
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- LZ6500000
- ridadr
- UN 3077 9 / PGIII
- HS 번호
- 29389090
화학 및 산업
용도 및 제조
UsesCIR ingredient: Ammonium Glycyrrhizate
Household ProductsInformation on 5 consumer products that contain Ammonium glycyrrhizate in the following categories is provided:
Use Classification
Fragrance Ingredients
Cosmetics -> Skin conditioning
General Manufacturing Information.alpha.-D-Glucopyranosiduronic acid, (3.beta.,20.beta.)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 2-O-.beta.-D-glucopyranuronosyl-, ammonium salt (1:1): ACTIVE
응용 분야
개요§ 184.1408(a)(1) Licorice (glycyrrhiza) root is the dried and ground rhizome and root portions of Glycyrrhiza glabra or other species of glycyrrhiza. Licorice extract is that portion of the licorice root that is, after maceration, extracted by boiling water. The extract can be further purified by filtration and by treatment with acids and ethyl alcohol. Licorice extract is sold as a liquid paste ("block"), or spraydried powder. (2) Ammoniated glycyrrhizin is prepared from the water extract of licorice root by acid precipitation followed by neutralization with dilute ammonia. Monoammonium glycyrrhizinate (C42H61016NH45H2O ) is prepared from ammoniated glycyrrhizin by solvent extraction and separation techniques.
용도Glycyrrhizic acid ammonium salt is a flavoring and sweetening agent obtained from licorice flavonoids. It has a slight licorice flavor and an intense and rounded sweetness. It is soluble in water, glycerin, and propylene glycol and has good thermal stability but can degrade under prolonged heating. It is stable over a ph of 3.5–9 but could precipitate below ph of 3.5. It can be used in beverages, desserts, confectionary products, soups, and dressings.
일반 설명Produced and qualified by HWI pharma services GmbH.Exact content by quantitative NMR can be found on the certificate.
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