홈MCP워크벤치Skills
홈워크벤치알림마이페이지
Huagongshe 오픈 프로젝트：[email protected]AI 접속: llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.7.9
  1. 홈
  2. /화합물

모그로사이드IIA2

CID 131863038

HCID 178591105
새 노트새 반응견적 요청하기인쇄 미리보기
기본 정보이름 및 식별자물성화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
88901-45-5
표준 SMILES
C[C@H](CC[C@@H](O)C(C)(C)O)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@@H](CC[C@H](O[C@@H]5O[C@H](CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@H](O)[C@H](O)[C@H]5O)C4(C)C)[C@]3(C)[C@H](O)C[C@]12C
InChIKey
SLAWMGMTBGDBFT-NUTXKJHISA-N
분자식
C42H72O14
평균 분자량
801 g/mol
단동위원소 질량
800.49220697

이름 및 식별자

우선 이름
CID 131863038
IUPAC
(2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[[(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(2R,5R)-5,6-dihydroxy-6-methylheptan-2-yl]-11-hydroxy-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
현지명
모그로사이드IIA2
영어명
Mogroside II A2
분자식
C42H72O14
분자량
801.01

이름 및 동의어

Mogroside II-A288901-45-5MOGROSIDE IIA2(2R,3R,4S,5S,6R)-2-(((3S,8S,9R,10R,11R,13R,14S,17R)-17-((2R,5R)-5,6-Dihydroxy-6-methylheptan-2-yl)-11-hydroxy-4,4,9,13,14-pentamethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-6-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-3,4,5-triolorb1304672HY-N6944AKOS040750448EBC-617297T2S1194AC-34468MS-31478HY-108272
이름 더 보기
모그로사이드IIA2MogrosideⅡA2mogroside ⅡA2mogroside ⅡA2Mogroside II A2Momordica saponins IIa2inhibit,Mogroside II A2,Mogroside II-A2,Mogroside II-A-2,Mogroside IIA2,Inhibitorβ-D-Glucopyranoside, (3β,9β,10α,11α,24R)-11,24,25-trihydroxy-9-methyl-19-norlanost-5-en-3-yl 6-O-β-D-glucopyranosyl-b-D-Glucopyranoside, (3b,9b,10a,11a,24R)-11,24,25-trihydroxy-9-methyl-19-norlanost-5-en-3-yl6-O-b-D-glucopyranosyl- (9CI)

물성

구조 계산 물성

XLogP
1.7
극성 표면적
239 Ų
수소 결합 공여자 수
10
수소 결합 수용자 수
14
회전 가능 결합 수
11
무거운 원자 수
56
형식 전하
0
복잡도
1,410

물리화학적 성질

끓는 점
914.2 · 914.2±65.0 °C(Predicted)
밀도
1.33 · 1.33±0.1 g/cm3 (20 ºC 760 Torr)
용해도
Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
물리적 상태
가루
산도 계수 (pKa)
12.89 · 12.89±0.70(Predicted)
색상
White to off-white

화학 및 산업

응용 분야

용도Mogroside II-A2 is a glycoside of cucurbitane derivative. It is typically found in certain plants, such as the fruit of the gourd vine luo han guo (Siraitia grosvenorii).

공급사

불러오는 중…

공개 문의

불러오는 중…

관련 반응

0건
반응 기록 만들기

현재 필터 조건에 해당하는 반응 기록이 없습니다.

화합물 노트

불러오는 중…

이 페이지에서기본 정보이름 및 식별자물성화학 및 산업관련 반응화합물 노트
CS-0027941(2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[[(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(1R,4R)-4,5-dihydroxy-1,5-dimethyl-hexyl]-11-hydroxy-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-yl]methoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol(2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[[(3S,8S,9R,10R,11R,13R,14S,17R)-17-[(2R,5R)-5,6-dihydroxy-6-methylheptan-2-yl]-11-hydroxy-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol(2R,3R,4S,5S,6R)-2-{[(1R,3aS,3bS,7S,9aR,9bR,10R,11aR)-1-[(2R,5R)-5,6-dihydroxy-6-methylheptan-2-yl]-10-hydroxy-3a,6,6,9b,11a-pentamethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triol

데이터베이스 식별자

CAS
88901-45-5
PubChem CID
131863038