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NEOCARRAHEXADECAOSE-4(1,3,5,7,9,11,13,15)-옥타-O-황산염,옥타나트륨염

Neocarrahexadecaose-41,3,5,7,9,11,13,15-octa-O-sulfate sodium salt

HCID 178797244
노트반응
기본 정보이름 및 식별자물성화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
157297-04-6
표준 SMILES
O=C[C@H](O)[C@@H](O[C@H]1O[C@@H]2CO[C@H]([C@H]1O)[C@H]2O[C@@H]1O[C@H](CO)[C@H](OS(=O)(=O)[O-])[C@H](O[C@H]2O[C@@H]3CO[C@H]([C@H]2O)[C@H]3O[C@@H]2O[C@H](CO)[C@H](OS(=O)(=O)[O-])[C@H](O[C@H]3O[C@@H]4CO[C@H]([C@H]3O)[C@H]4O[C@@H]3O[C@H](CO)[C@H](OS(=O)(=O)[O-])[C@H](O[C@H]4O[C@@H]5CO[C@H]([C@H]4O)[C@H]5O[C@@H]4O[C@H](CO)[C@H](OS(=O)(=O)[O-])[C@H](O[C@H]5O[C@@H]6CO[C@H]([C@H]5O)[C@H]6O[C@@H]5O[C@H](CO)[C@H](OS(=O)(=O)[O-])[C@H](O[C@H]6O[C@@H]7CO[C@H]([C@H]6O)[C@H]7O[C@@H]6O[C@H](CO)[C@H](OS(=O)(=O)[O-])[C@H](O[C@H]7O[C@@H]8CO[C@H]([C@H]7O)[C@H]8O[C@@H]7O[C@H](CO)[C@H](OS(=O)(=O)[O-])[C@H](O[C@H]8O[C@@H]9CO[C@@H]([C@H]9O)[C@H]8O)[C@H]7O)[C@H]6O)[C@H]5O)[C@H]4O)[C@H]3O)[C@H]2O)[C@H]1O)[C@H](OS(=O)(=O)[O-])[C@H](O)CO.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
InChIKey
OHYXSPYSIRUMQU-KQOQITQLSA-F
분자식
C96H138Na8O97S8
평균 분자량
3,284.5 g/mol

이름 및 식별자

우선 이름
Neocarrahexadecaose-41,3,5,7,9,11,13,15-octa-O-sulfate sodium salt
IUPAC
octasodium;[(2R,3S,4R,5R,6S)-4-[[(1R,3R,4R,5S,8S)-4,8-dihydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-5-hydroxy-6-[[(1R,3R,4R,5R,8S)-4-hydroxy-3-[(2S,3R,4R,5S,6R)-3-hydroxy-2-[[(1R,3R,4R,5R,8S)-4-hydroxy-3-[(2S,3R,4R,5S,6R)-3-hydroxy-2-[[(1R,3R,4R,5R,8S)-4-hydroxy-3-[(2S,3R,4R,5S,6R)-3-hydroxy-2-[[(1R,3R,4R,5R,8S)-4-hydroxy-3-[(2S,3R,4R,5S,6R)-3-hydroxy-2-[[(1R,3R,4R,5R,8S)-4-hydroxy-3-[(2S,3R,4R,5S,6R)-3-hydroxy-2-[[(1R,3R,4R,5R,8S)-4-hydroxy-3-[(2R,3S,4R,5R,6S)-5-hydroxy-2-(hydroxymethyl)-6-[[(1R,3R,4R,5R,8S)-4-hydroxy-3-[(2R,3R,4R,5R)-2,5,6-trihydroxy-1-oxo-4-sulfonatooxyhexan-3-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-3-sulfonatooxyoxan-4-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-6-(hydroxymethyl)-5-sulfonatooxyoxan-4-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-6-(hydroxymethyl)-5-sulfonatooxyoxan-4-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-6-(hydroxymethyl)-5-sulfonatooxyoxan-4-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-6-(hydroxymethyl)-5-sulfonatooxyoxan-4-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-6-(hydroxymethyl)-5-sulfonatooxyoxan-4-yl]oxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-2-(hydroxymethyl)oxan-3-yl] sulfate
현지명
NEOCARRAHEXADECAOSE-4(1,3,5,7,9,11,13,15)-옥타-O-황산염,옥타나트륨염
영어명
Neocarrahexadecaose-4(1,3,5,7,9,11,13,15)-octa-O-sulfate, octasodium salt
분자식
C96H138Na8O97S8
분자량
3284.5

이름 및 동의어

157297-04-6Neocarrahexadecaose-41,3,5,7,9,11,13,15-octa-O-sulfate sodium saltNEOCARRAHEXADECAOSE-4(1,3,5,7,9,11,13,15)-옥타-O-황산염,옥타나트륨염OHYXSPYSIRUMQU-KQOQITQLSA-Fneocarrahexadecaose octa-4-sulfate,*sodiumNEOCARRAHEXADECAOSE-4-OCTA-O-SULPHATE (NA+)Neocarrahexadecaose octa-4-sulfate sodium saltNeocarrahexadecaose-4(1,3,5,7,9,11,13,15)-octa-O-sulfateNeocarrahexadecaose-4(1,3,5,7,9,11,13,15)-octa-O-sulfate, octasodium salt[O-3,6-Anhydro-alpha-D-galactopyranosyl-(1-3)-O-4-O-sulfo-beta-D-galactopyranosyl-(1-4)]7-O-3,6-anhydro-alpha-D-galactopyranosyl-(1-3)-D-galactose 4-(hydrogen sulfate) sodium salt

데이터베이스 식별자

CAS
157297-04-6

물성

구조 계산 물성

극성 표면적
1,490 Ų
수소 결합 공여자 수
26
수소 결합 수용자 수
97
회전 가능 결합 수
50
무거운 원자 수
209
형식 전하
0
복잡도
7,210

물리화학적 성질

저장 조건
2 · 2-8°C

화학 및 산업

공급사4 곳

上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
上海贝万塔生物科技有限公司021-67187366 19901745723 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]

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