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Chemistry

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Also known as: 27994-11-2, Cimigenol xyloside, Cimigoside, 1cw26vcp4h, Chebi:70246, (2s,3r,4s,5r)-2-[[(1s,2r,3s,4r,7r,9s,12r,14s,17r,18r,19r,21r,22s)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol
Molecular Formula
C35H56O9
Molecular Weight
620.8  g/mol
InChI Key
BTPYUWOBZFGKAI-XYGBCAHESA-N
FDA UNII
1CW26VCP4H

Cimigenoside
cimigenol xyloside is a natural product found in Actaea pachypoda, Actaea dahurica, and other organisms with data available.
1 2D Structure

Cimigenoside

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S,3R,4S,5R)-2-[[(1S,2R,3S,4R,7R,9S,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol
2.1.2 InChI
InChI=1S/C35H56O9/c1-17-14-19-26(30(4,5)40)44-35(43-19)25(17)31(6)12-13-34-16-33(34)11-10-22(42-27-24(38)23(37)18(36)15-41-27)29(2,3)20(33)8-9-21(34)32(31,7)28(35)39/h17-28,36-40H,8-16H2,1-7H3/t17-,18-,19-,20+,21+,22+,23+,24-,25-,26+,27+,28-,31-,32-,33-,34+,35+/m1/s1
2.1.3 InChI Key
BTPYUWOBZFGKAI-XYGBCAHESA-N
2.1.4 Canonical SMILES
CC1CC2C(OC3(C1C4(CCC56CC57CCC(C(C7CCC6C4(C3O)C)(C)C)OC8C(C(C(CO8)O)O)O)C)O2)C(C)(C)O
2.1.5 Isomeric SMILES
C[C@@H]1C[C@@H]2[C@H](O[C@]3([C@H]1[C@]4(CC[C@@]56C[C@@]57CC[C@@H](C([C@@H]7CC[C@H]6[C@@]4([C@H]3O)C)(C)C)O[C@H]8[C@@H]([C@H]([C@@H](CO8)O)O)O)C)O2)C(C)(C)O
2.2 Other Identifiers
2.2.1 UNII
1CW26VCP4H
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Beta-d-xylopyranoside, (3beta,15alpha,16alpha,23r,24s)-16,23-16,24-diepoxy-15,25-dihydroxy-9,19-cyclolanostan-3-yl

2.3.2 Depositor-Supplied Synonyms

1. 27994-11-2

2. Cimigenol Xyloside

3. Cimigoside

4. 1cw26vcp4h

5. Chebi:70246

6. (2s,3r,4s,5r)-2-[[(1s,2r,3s,4r,7r,9s,12r,14s,17r,18r,19r,21r,22s)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-yl]oxy]oxane-3,4,5-triol

7. Cimigenoside Xyloside

8. Unii-1cw26vcp4h

9. Cimigenol 3-beta-d-xylopyranoside

10. Cimicifugol Xyloside

11. Chembl218613

12. Dtxsid0033334

13. Cimigenol-3-o-beta-d-xylopyranoside

14. Zinc49942441

15. Akos030573698

16. .beta.-d-xylopyranoside, (3.beta.,15.alpha.,16.alpha.,23r,24s)-16,23:16,24-diepoxy-15,25-dihydroxy-9,19-cyclolanostan-3-yl

17. Beta-d-xylopyranoside, (3beta,15alpha,16alpha,23r,24s)-16,23:16,24-diepoxy-15,25-dihydroxy-9,19-cyclolanostan-3-yl

18. Cimigenol 3-o-.beta.-d-xylopyranoside

19. Q27138585

20. Cimigenol-3-o-.beta.-d-xyloside (24s) (constituent Of Black Cohosh) [dsc]

2.4 Create Date
2007-06-18
3 Chemical and Physical Properties
Molecular Weight 620.8 g/mol
Molecular Formula C35H56O9
XLogP33.7
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Exact Mass620.39243336 g/mol
Monoisotopic Mass620.39243336 g/mol
Topological Polar Surface Area138 Ų
Heavy Atom Count44
Formal Charge0
Complexity1210
Isotope Atom Count0
Defined Atom Stereocenter Count17
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

ABOUT THIS PAGE

Cimigenoside Manufacturers

A Cimigenoside manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Cimigenoside, including repackagers and relabelers. The FDA regulates Cimigenoside manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Cimigenoside API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

Cimigenoside Suppliers

A Cimigenoside supplier is an individual or a company that provides Cimigenoside active pharmaceutical ingredient (API) or Cimigenoside finished formulations upon request. The Cimigenoside suppliers may include Cimigenoside API manufacturers, exporters, distributors and traders.

Cimigenoside GMP

Cimigenoside Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Cimigenoside GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Cimigenoside GMP manufacturer or Cimigenoside GMP API supplier for your needs.

Cimigenoside CoA

A Cimigenoside CoA (Certificate of Analysis) is a formal document that attests to Cimigenoside's compliance with Cimigenoside specifications and serves as a tool for batch-level quality control.

Cimigenoside CoA mostly includes findings from lab analyses of a specific batch. For each Cimigenoside CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Cimigenoside may be tested according to a variety of international standards, such as European Pharmacopoeia (Cimigenoside EP), Cimigenoside JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Cimigenoside USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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