delta'-Dehydrocortexolone
Also known as 17,21-Dihydroxypregna-1,4-diene-3,20-dione, 11-Deoxyprednisolone, delta1,4-Reichstein S
Key facts
What buyers check first
- CAS number
- 1807-14-3
- Formula
- C21H28O4
- Molar mass
- 344.45 g/mol
- EC number
- 894-333-6
- HS code
- 291440
- Category
- Impurities and reference standards
What is delta'-Dehydrocortexolone?
Plain description, key identifiers and synonyms
delta'-Dehydrocortexolone is a chemical substance with the molecular formula C21H28O4 and a molar mass of 344.45 g/mol. Its CAS registry number is 1807-14-3. The IUPAC name is (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
- CAS number
- 1807-14-3 CAS number cross-checked
- EC number
- 894-333-6
- Molecular formula
- C21H28O4
- UNII
- T89KRT8XVE
- InChIKey
- BVAYTJBBDODANA-OBQKJFGGSA-N
- InChI
- InChI=1S/C21H28O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h5,8,11,15-17,22,25H,3-4,6-7,9-10,12H2,1-2H3/t15-,16+,17+,19+,20+,21+/m1/s1
- Canonical SMILES
- CC12C=CC(=O)C=C1CCC1C2CCC2(C)C1CCC2(O)C(=O)CO
- Isomeric SMILES
- C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)CCC4=CC(=O)C=C[C@]34C
Synonyms
- 17,21-Dihydroxypregna-1,4-diene-3,20-dione
- 11-Deoxyprednisolone
- delta1,4-Reichstein S
- Prednisolone impurity J
- Pregna-1,4-diene-3,20-dione, 17,21-dihydroxy-
- (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
- Delta.'-dehydrocortexolone
- 17alpha,21-Dihydroxypregn-1,4-dien-3,20-dione
- Prednisolone impurity j (ep impurity)
- (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta(a)phenanthren-3-one
- 11-Deoxy Prednisolone
- Prednisolone EP Impurity J
- (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one
- 17,21-dihydroxy-pregna-1,4-diene-3,20-dione
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 344.45 g/molcalc.Computed value |
|---|---|
| Exact mass | 344.1988 Dacalc.Computed value |
| LogP (octanol/water) | 2.59calc.Computed value |
| Topological polar surface area | 74.6 Ųcalc.Computed value |
| Hydrogen bond donors | 2calc.Computed value |
| Hydrogen bond acceptors | 4calc.Computed value |
| Rotatable bonds | 2calc.Computed value |
| Heavy atoms | 25calc.Computed value |
| Rings | 4calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.71calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 6calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H302Harmful if swallowed.
Precautionary statements (5)
- P264Wash skin thoroughly after handling.
- P270Do not eat, drink or smoke when using this product.
- P301 + P317If swallowed: Get medical help.
- P330Rinse mouth.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aiddelta'-Dehydrocortexolone suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- IndiaUnclaimed profileDelta'-DehydrocortexoloneGrade, purity and minimum order on requestPrice on request
Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.
Where suppliers are based
1 supplier in 1 country
Send one request to many suppliers
Choose up to 10 suppliers or let us match your request. Compare quotes side by side, free.
delta'-Dehydrocortexolone price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code delta'-Dehydrocortexolone is traded under.
Ketone-alcohols and ketone-aldehydes
- China29.5%
- Germany14.4%
- Netherlands12.7%
- United States37.2%
- Netherlands8.5%
- Germany6.4%
The HS code shown for delta'-Dehydrocortexolone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about delta'-Dehydrocortexolone, based on the data on this page
What is delta'-Dehydrocortexolone?
What is the CAS number of delta'-Dehydrocortexolone?
What is the molecular formula and weight of delta'-Dehydrocortexolone?
Is delta'-Dehydrocortexolone hazardous?
What is the HS code of delta'-Dehydrocortexolone?
Where can I buy delta'-Dehydrocortexolone?
Where can I buy delta'-Dehydrocortexolone in India?
What is the price of delta'-Dehydrocortexolone?
Guides for buyers
Practical guides that help when you source, ship or handle delta'-Dehydrocortexolone
- Article, QualityPharma grades explained: IP vs BP vs USP vs EPWhat the Indian, British, US and European pharmacopoeias are, how their monographs differ, what multi grade claims mean and why a grade alone does not make a product fit for medicines.Read
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
Get quotes for delta'-Dehydrocortexolone
Embed this structure on your websiteShow code
Paste this code into your page to show the 2D structure of delta'-Dehydrocortexolone with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.
<iframe src="https://www.compoundlist.com/embed/structure/delta-dehydrocortexolone-1807-14-3" title="delta'-Dehydrocortexolone structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>Explore more in Impurities and reference standards or HS code 291440