简介名称和标识符别名信息物化性质相关文献专业数据库参考化合物详情（旧版）

皂苷 QA 21V1 | 141256-04-4

中文名称：皂苷 QA 21V1

英文名称： QS 21

CAS No.： 141256-04-4

分子式： C₉₂H₁₄₈O₄₆

分子量： 1990.13192g/mol

如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击：皂苷 QA 21V1结构式

PubChem CID： 72809956

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简介

中文名称:QS-21CAS:141256-04-4英文名称:QS-21 ADJUVANTEINECS: 分子式:C92H148O46分子量:1990.14

名称和标识符

InChIKey	CNEYUDLWGDOPIY-HUUTXQBQSA-N
Inchi	1S/C92H148O46/c1-13-36(3)46(126-54(102)25-41(98)24-47(37(4)14-2)127-80-63(111)59(107)49(30-94)128-80)23-40(97)26-55(103)131-70-56(104)38(5)124-82(73(70)136-79-65(113)61(109)68(39(6)125-79)132-78-67(115)69(45(100)32-122-78)133-84-75(116)91(120,34-96)35-123-84)138-85(119)92-22-21-86(7,8)27-43(92)42-15-16-51-87(9)19-18-53(88(10,33-95)50(87)17-20-89(51,11)90(42,12)28-52(92)101)130-83-74(137-81-64(112)60(108)58(106)48(29-93)129-81)71(66(114)72(135-83)76(117)118)134-77-62(110)57(105)44(99)31-121-77/h15,33,36-41,43-53,56-75,77-84,93-94,96-101,104-116,120H,13-14,16-32,34-35H2,1-12H3,(H,117,118)/t36?,37?,38-,39-,40?,41?,43+,44+,45+,46?,47?,48+,49-,50+,51?,52+,53-,56+,57-,58-,59-,60-,61-,62+,63+,64+,65+,66-,67+,68-,69-,70+,71-,72-,73-,74+,75-,77+,78+,79-,80+,81-,82+,83+,84+,87-,88-,89+,90+,91+,92+/m0/s1
SMILES	[C@@]12(CCC(C)(C)C[C@]1([H])C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@@H]([C@@H](O)[C@H](O[C@H]6OC[C@@H](O)[C@H](O)[C@H]6O)[C@H]5O[C@H]5[C@H](O)[C@H]([C@@H](O)[C@@H](CO)O5)O)C(=O)O)[C@@](C)(C=O)[C@]4([H])CC[C@@]3(C)[C@]1(C)C[C@H]2O)C(=O)O[C@H]1O[C@H]([C@@H](O)[C@@H](OC(=O)CC(O)CC(C(C)CC)OC(=O)CC(O)CC(C(C)CC)O[C@H]2[C@H](O)[C@@H](O)[C@H](CO)O2)[C@@H]1O[C@@H]1O[C@H]([C@H](O[C@H]2OC[C@@H](O)[C@H](O[C@H]3OC[C@](O)(CO)[C@H]3O)[C@H]2O)[C@@H](O)[C@H]1O)C)C

别名信息

- 中文别名 -

皂苷 QA 21V1
(2S,3S,4S,5R,6R)-6-(((3S,4S,4AR,6AR,6BS,8R,8AR,12AS,14AR,14BR)-8A-((((2S,3R,4S,5R,6R)-3-(((2S,3R,4S,5R,6S)-5-(((2S,3R,4S,5R)-4-(((2S,3R,4R)-3,4-二羟基-4-(羟甲基)四氢呋喃-2-基)氧基)-3,5-二羟基四氢-2H-吡喃-2-基)氧基)-3,4-二羟基-6-甲基四氢-2H-吡喃-2-基)氧基)-5-(((3S,5S,6S)-5-(((3S,5S,6S)-5-(((2R,3R,4R,5S)-3,4-二羟基-5-(羟甲基)四氢呋喃-2-基)氧基)-3-羟

- 英文别名 -

QS-21
QS-21 ADJUVANT
b-D-Glucopyranosiduronic acid, (3b,4a,16a)-28-[[O-D-apio-b-D-furanosyl-(1®3)-O-b-D-xylopyranosyl-(1®4)-O-6-deoxy-a-L-mannopyranosyl-(1®2)-4-O-[5-[[5-(a-L-arabinofuranosyloxy)-3-hydroxy-6-methyl-1-oxooctyl]oxy]-3-hydroxy-6-methyl-1-oxooctyl]-6-deoxy-b-D-galactopyranosyl]oxy]-16-hydroxy-23,28-dioxoolean-12-en-3-ylO-b-D-galactopyranosyl-(1®2)-O-[b-D-xylopyranosyl-(1®3)]-
(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8R,8aR,12aS,14aR,14bR)-8a-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4R,5R)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-3,4-dihydroxy-tetrahydropyran-2-yl]oxy-3,4-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-5-[5-[5-[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxy-3-hydroxy-6-methyl-octanoyl]oxy-3-hydroxy-6-methyl-octanoyl]oxy-4-h
QA 21

QA 21V1
QS 21
QS-21-Api
Saponin QA 21V1
CL130
β-D-Glucopyranosiduronic acid, (3β,4α,16α)-28-[[O-D-apio-β-D-furanosyl-(1→3)-O-β-D-xylopyranosyl-(1→4)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-4-O-[5-[[5-(α-L-arabinofuranosyloxy)-3-hydroxy-6-methyl-1-oxooctyl]oxy]-3-hydroxy-6-methyl-1-oxooctyl]-6-deoxy-β-D-galactopyranosyl]oxy]-16-hydroxy-23,28-dioxoole...

物化性质

实验特性

计算特性

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专业数据库参考

PubChemId	72809956

化合物详情（旧版）

QS-21物理化学性质

鉴定方法：Mass, NMR
分析方法：HPLC-DAD or/and HPLC-ELSD

QS-21产品用途

用途：用于含量测定、鉴定、药理实验等。

QS-21提取来源

植物皂树Quillaja saponaria

QS-21储运特性

4℃冷藏、密封、避光

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