폴리필린E(RG)
(2R,3S,4R,5S)-2-methyl-6-[(2R,4S,5R,6R)-2-methyl-6-[(1S,2S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxane-3,4,5-triol
기본 정보
- CAS
76296-74-7- 표준 SMILES
C[C@@H]1CC[C@@]2(OC1)OC1C[C@H]3[C@@H]4CC=C5CC(O[C@@H]6O[C@H](C)C(OC7O[C@H](C)[C@@H](O)[C@@H](O)[C@@H]7O)[C@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H]6OC6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C- InChIKey
PLDYAXVZGBUCAG-UEMJIXAHSA-N- 분자식
- C51H82O20
- 평균 분자량
- 1,015.2 g/mol
- 단동위원소 질량
- 1,014.539945
이름 및 식별자
- 우선 이름
- (2R,3S,4R,5S)-2-methyl-6-[(2R,4S,5R,6R)-2-methyl-6-[(1S,2S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxane-3,4,5-triol
- IUPAC
- (2R,3S,4R,5S)-2-methyl-6-[(2R,4S,5R,6R)-2-methyl-6-[(1S,2S,5'R,6R,7S,8R,9S,12S,13R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxyoxane-3,4,5-triol
- 현지명
- 폴리필린E(RG)
- 영어명
- POLYPHYLLIN E (RG)
- 분자식
- C51H82O20
- 분자량
- 1015.19
이름 및 동의어
76296-74-7DTXSID50856574HY-W019830DA-66799CS-0031621(16xi,25R)-Spirost-5-en-3-yl 6-deoxy-D-altropyranosyl-(1->4)-[6-deoxy-alpha-L-mannopyranosyl-(1->3)]-[D-glucopyranosyl-(1->2)]-(4xi)-6-deoxy-beta-D-xylo-hexopyranoside폴리필린E(RG)POLYPHYLLIN E (RG)a-L-Mannopyranoside, (3b,25R)-spirost-5-en-3-ylO-6-deoxy-a-L-mannopyranosyl-(13)-O-[6-deoxy-a-L-mannopyranosyl-(14)]-O-[b-D-glucopyranosyl-(12)]-6-deoxy-α-L-Mannopyranoside, (3β,25R)-spirost-5-en-3-yl O-6-deoxy-α-L-mannopyranosyl-(1→3)-O-[6-deoxy-α-L-mannopyranosyl-(1→4)]-O-[β-D-glucopyranosyl-(1→2)]-6-deoxy-O-6-Deoxy-alpha-L-mannopyranosyl-(1-3)-O-[6-deoxy-alpha-L-mannopyranosyl-(1-4)]-O-[beta-D-glucopyranosyl-(1-2)]-6-deoxy-alpha-L-mannopyranoside (3beta,25R)-spirost-5-en-3-yl
데이터베이스 식별자
- CAS
물성
구조 계산 물성
- XLogP
- 0.8
- 극성 표면적
- 295 Ų
- 수소 결합 공여자 수
- 10
- 수소 결합 수용자 수
- 20
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 71
- 형식 전하
- 0
- 복잡도
- 1,900
물리화학적 성질
- 밀도
- 1.43 · 1.43
- 용해도
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- 물리적 상태
- 가루
- 산도 계수 (pKa)
- 12.89 · 12.89±0.70(Predicted)
화학 및 산업
공급사20 곳
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
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成都锦然生物科技有限公司028-83311324 1278112614 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
武汉天植生物技术有限公司18607101326 15172504745 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
陕西萃程生物医药科技有限公司13186333400 · [email protected]
上海澄绍生物科技有限公司021-61847300 13341622919 · [email protected]
成都草源康生物科技有限公司13438898246 13438898246 · [email protected]
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上海同田生物技术有限公司021-51320588 · [email protected]
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