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Hederacoside C structure, CAS 14216-03-6

Hederacoside C

CAS Number14216-03-6

SynonymsHederacol; Akebia saponin pk; Hederoside H1; Hederacauide D; Glycoside L-H2; kizutasaponin K12; Tauroside H2; hederasaponin C; Hederacoside C; Astrantiasaponin H

Molecular FormulaC59H96O26

Molecular Weight1221.38

Purity

Density1.5±0.1 g/cm3

Boiling Point

Melting Point222ºC (dec.)(lit.)

Flash Point

Appearance

EINECS

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Cat. No.: 2A-9093129 Purity:
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Quality Control of [ 14216-03-6 ] SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number14216-03-6
Catalog No.2A-9093129
Chinese Name常春藤苷C； 常春藤皂苷C
SynonymsHederacol; Akebia saponin pk; Hederoside H1; Hederacauide D; Glycoside L-H2; kizutasaponin K12; Tauroside H2; hederasaponin C; Hederacoside C; Astrantiasaponin H
Molecular FormulaC59H96O26
Molecular Weight1221.38
Density1.5±0.1 g/cm3
Melting Point222ºC (dec.)(lit.)
Storage Condition2-8°C
ApplicationHederacoside C is the main bioactive pharmaceutical component of ivy leaves. It can treat respiratory diseases due to its expectorant, bronchodilator, antibacterial and other effects.
PubChem ID329747167
SMILESCC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8OC8OC(C)C(O)C(O)C8O)C(C)(CO)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
InChIInChI=1S/C59H96O26/c1-24-34(63)38(67)42(71)49(78-24)83-46-29(20-60)80-48(45(74)41(46)70)77-22-30-37(66)40(69)44(73)51(81-30)85-53(75)59-17-15-54(3,4)19-27(59)26-9-10-32-55(5)13-12-33(56(6,23-61)31(55)11-14-58(32,8)57(26,7)16-18-59)82-52-47(36(65)28(62)21-76-52)84-50-43(72)39(68)35(64)25(2)79-50/h9,24-25,27-52,60-74H,10-23H2,1-8H3/t24-,25-,27-,28-,29+,30+,31+,32+,33-,34-,35-,36-,37+,38+,39+,40-,41+,42+,43+,44+,45+,46+,47?,48?,49-,50-,51-,52-,55-,56-,57+,58+,59-/m0/s1
InChI KeyRYHDIBJJJRNDSX-MCGLQMIESA-N
Hazard Symbolstransportation
BioactivityHederacoside C is a principal bioactive pharmaceutical ingredient of Hedera helix leaf that can treat respiratory disorders, because of its expectorant, bronchodilator, antibacterial, and bronchospasmolytic effects. Related Catalog Signaling Pathways >> Others >> Others Research Areas >> Infection Natural Products >> Terpenoids and Glycosides References [1]. Rehman SU et al. An ultra-high-performance liquid chromatography-tandem mass spectrometric method for the determination ofhederacoside C, a drug candidate for respiratory disorder, in rat plasma. J Pharm Biomed Anal. 2016 Jun 24;129:90-95. [2]. Kim JM et al. Pharmacokinetics of hederacoside C, an active ingredient in AG NPP709, in rats. Xenobiotica. 2013 Nov;43(11):985-92. Chemical & Physical Properties Density 1.5±0.1 g/cm3 Melting Point 222ºC (dec.)(lit.) Molecular Formula C59H96O26 Molecular Weight 1221.378 Exact Mass 1220.619019 PSA 412.82000 LogP 4.52 Index of Refraction 1.637 InChIKey RYHDIBJJJRNDSX-MCGLQMIESA-N SMILES CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8OC8OC(C)C(O)C(O)C8O)C(C)(CO)C7CCC6(C)C4(C)CC5)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O Storage condition 2-8°C
Use ofHederacoside C is a principal bioactive pharmaceutical ingredient of Hedera helix leaf that can treat respiratory disorders, because of its expectorant, bronchodilator, antibacterial, and bronchospasmolytic effects. Properties Name kalopanaxsaponin B Synonym More Synonyms Hederacoside C Biological Activity Description Hederacoside C is a principal bioactive pharmaceutical ingredient of Hedera helix leaf that can treat respiratory disorders, because of its expectorant, bronchodilator, antibacterial, and bronchospasmolytic effects. Related Catalog Signaling Pathways >> Others >> Others Research Areas >> Infection Natural Products >> Terpenoids and Glycosides References [1]. Rehman SU et al. An ultra-high-performance liquid chromatography-tandem mass spectrometric method for the determination ofhederacoside C, a drug candidate for respiratory disorder, in rat plasma. J Pharm Biomed Anal. 2016 Jun 24;129:90-95. [2]. Kim JM et al. Pharmacokinetics of hederacoside C, an active ingredient in AG NPP709, in rats. Xenobiotica. 2013 Nov;43(11):985-92. Chemical & Physical Properties Molecular Formula C59H96O26 Exact Mass 1220.619019 PSA 412.82000 Index of Refraction 1.637 InChIKey RYHDIBJJJRNDSX-MCGLQMIESA-N
Transport InfoShipping Name: UN
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Dangerous Regulations for land transport: 2811 International Dangerous Regulations for sea transport: 2811 International Dangerous Regulations for air transport: 2811 14.2 United Nations shipping name European Land Transport Dangerous Regulations: TOXIC SOLID, ORGANIC, N.O.S. (Hederacoside C) IMDG Code: TOXIC SOLID, ORGANIC, N.O.S. (Hederacoside C) International air transport hazard regulations: Toxic solid, organic, n.o.s. (Hederacoside C) 14.3 Transport hazard categories European Land Transport Danger Regulations: 6.1 International Maritime Transport Danger Regulations: 6.1 International Air Transport Danger Regulations: 6.1 14.4 Package group European Land Transport Danger Regulations: III International Maritime Transport Danger Regulations: III International Air Transport Danger Regulations: III 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available The above information is believed to be correct, but is not all-inclusive and should be used as a guide only. The information in this document is based on our current knowledge and is Correct safety instructions apply to this product. This information does not represent a warranty as to the properties of this product. See reverse side of invoice or packing slip.
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