Home > Products > Specialty & Industrial Chemicals > Specialty Chemicals > (3beta,4beta,16alpha,21beta,22alpha)-28-(Acetyloxy)-16,22,23-trihydroxy-21-[[(2Z)-2-methyl-1-oxo-2-buten-1-yl]oxy]olean-12-en-3-yl O-beta-D-glucopyranosyl-(1-2)-O-[beta-D-glucopyranosyl-(1-4)]-beta-D-glucopyranosiduronic acid

(3beta,4beta,16alpha,21beta,22alpha)-28-(Acetyloxy)-16,22,23-trihydroxy-21-[[(2Z)-2-methyl-1-oxo-2-buten-1-yl]oxy]olean-12-en-3-yl O-beta-D-glucopyranosyl-(1-2)-O-[beta-D-glucopyranosyl-(1-4)]-beta-D-glucopyranosiduronic acid

Name: (3beta,4beta,16alpha,21beta,22alpha)-28-(Acetyloxy)-16,22,23-trihydroxy-21-[[(2Z)-2-methyl-1-oxo-2-buten-1-yl]oxy]olean-12-en-3-yl O-beta-D-glucopyranosyl-(1-2)-O-[beta-D-glucopyranosyl-(1-4)]-beta-D-glucopyranosiduronic acid
Brand: 2A Biotech
SKU: 2A-1179499

CAS Number219944-46-4

SynonymsAescin D; Escin IVb; Isoescin Ib

Molecular FormulaC55H86O24

Molecular Weight1131.26

Density1.5±0.1 g/cm3

Boiling Point1148.1±65.0 °C at 760 mmHg

Appearancewhite powder

MSDSChinese English

Cat. No.: 2A-1179499 Purity:

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Quality Control of [ 219944-46-4 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number	219944-46-4
Catalog No.	2A-1179499
Chinese Name	异七叶皂苷IB; 七叶皂苷D
Synonyms	Aescin D; Escin IVb; Isoescin Ib
Molecular Formula	C55H86O24
Molecular Weight	1131.26
Density	1.5±0.1 g/cm3
Boiling Point	1148.1±65.0 °C at 760 mmHg
Appearance	white powder
Storage Condition	2-8°C, sealed, dry
Application	Isoescin IB is isolated from horse chestnut seeds. Isoescin IB is an isomer of Escin IB. Isoescin IB and Escin IB are the main active ingredients in Escin.
PubChem ID	645463
MDL Number	MFCD12031630
SMILES	CC=C(C)C(=O)OC1C(O)C2(COC(C)=O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC43C)C2CC1(C)C
InChI	InChI=1S/C55H86O24/c1-10-23(2)46(71)79-44-43(68)55(22-72-24(3)59)26(17-50(44,4)5)25-11-12-30-51(6)15-14-32(52(7,21-58)29(51)13-16-53(30,8)54(25,9)18-31(55)60)75-49-41(77-48-38(66)36(64)34(62)28(20-57)74-48)39(67)40(42(78-49)45(69)70)76-47-37(65)35(63)33(61)27(19-56)73-47/h10-11,26-44,47-49,56-58,60-68H,12-22H2,1-9H3,(H,69,70)/b23-10-/t26-,27+,28+,29+,30+,31+,32-,33+,34+,35-,36-,37+,38+,39-,40-,41+,42-,43-,44-,47-,48-,49+,51-,52+,53+,54+,55-/m0/s1
InChI Key	YOSIWGSGLDDTHJ-OXPBSUTMSA-N
NACRES Code	NA.24
UNSPSC	41116107
Transport Info	Product Name: Isoaescin Ib

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(3beta,4beta,16alpha,21beta,22alpha)-28-(Acetyloxy)-16,22,23-trihydroxy-21-[[(2Z)-2-methyl-1-oxo-2-buten-1-yl]oxy]olean-12-en-3-yl O-beta-D-glucopyranosyl-(1-2)-O-[beta-D-glucopyranosyl-(1-4)]-beta-D-glucopyranosiduronic acid

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