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Escin IA structure, CAS 123748-68-5

Escin IA

CAS Number123748-68-5

SynonymsAescin A

Molecular FormulaC55H86O24

Molecular Weight1131.26

Purity≥90.0 (HPLC)%

Density1.46

Boiling Point1140.6±65.0 °C at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9051587 Purity: ≥90.0 (HPLC)%
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Quality Control of [ 123748-68-5 ] Purity: ≥90.0 (HPLC)% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number123748-68-5
Catalog No.2A-9051587
Chinese Name七叶皂苷 IA
SynonymsAescin A
Molecular FormulaC55H86O24
Molecular Weight1131.26
Purity≥90.0 (HPLC)
Density1.46
Boiling Point1140.6±65.0 °C at 760 mmHg
Storage Conditionroom temperature
ApplicationEscin IA is a triterpenoid saponin isolated from horse chestnut. It inhibits HIV-1 protease with an IC50 value of 35 μM. Escin IA has anti-metastasis activity in triple-negative breast cancer. Its mec
MDL NumberMFCD10566608
SMILESO1[C@H]([C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O)O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O[C@@H]8O[C@@H]([C@H]([C@@H]([C@H]8O)O)O)CO)C(=O)O)O[C@@H]3[C@@]([C@H]4[C@@]([C@@H]5[C@]([C@@]6(C[C@H]([C@@]7([C@@H](CC([C@H]([C@@H]7OC(=O)C)OC(=O)\C(=C\C)\C)(C)C)C6=CC5)CO)O)
InChI1S/C55H86O24/c1-10-23(2)46(71)79-43-44(72-24(3)60)55(22-59)26(17-50(43,4)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)61)75-49-41(77-48-38(67)36(65)34(63)28(20-57)74-48)39(68)40(42(78-49)45(69)70)76-47-37(66)35(64)33(62)27(1
InChI KeyAXNVHPCVMSNXNP-IVKVKCDBSA-N
NACRES CodeNA.24
UNSPSC41116107
MSDSmsds/51587_1_123748_68_5.pdf
Transport InfoProduct name: Aescin Ia
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