Pyracrenic acid | CAS#80832-44-6

MedKoo Cat#: 528036 | Name: Pyracrenic acid

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Pyracrenic acid is a lupane from bark of Pyracantha crenulata.

Chemical Structure

Pyracrenic acid

CAS#80832-44-6

Theoretical Analysis

MedKoo Cat#: 528036

Name: Pyracrenic acid

CAS#: 80832-44-6

Chemical Formula: C39H54O6

Exact Mass: 618.3920

Molecular Weight: 618.86

Elemental Analysis: C, 75.69; H, 8.80; O, 15.51

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.

Bulk Inquiry

Related CAS #

No Data

Synonym

Pyracrenic acid

IUPAC/Chemical Name

Lup-20(29)-en-28-oic acid, 3-((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-, (3beta(E))-

InChi Key

MNUNUJQYFJZRHQ-VZLLCJDWSA-N

InChi Code

InChI=1S/C39H54O6/c1-23(2)25-14-19-39(34(43)44)21-20-37(6)26(33(25)39)10-12-30-36(5)17-16-31(35(3,4)29(36)15-18-38(30,37)7)45-32(42)13-9-24-8-11-27(40)28(41)22-24/h8-9,11,13,22,25-26,29-31,33,40-41H,1,10,12,14-21H2,2-7H3,(H,43,44)/b13-9+/t25-,26+,29-,30+,31-,33+,36-,37+,38+,39-/m0/s1

SMILES Code

CC1(C)[C@@H](OC(/C=C/C2=CC=C(O)C(O)=C2)=O)CC[C@]3(C)[C@@]4([H])CC[C@]5([H])[C@@]6([H])[C@H](C(C)=C)CC[C@@](C(O)=O)6CC[C@](C)5[C@@](C)4CC[C@@]13[H]

Appearance

Solid powder

Purity

>98% (or refer to the Certificate of Analysis)

Shipping Condition

Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition

Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility

Soluble in DMSO

Shelf Life

>3 years if stored properly

Drug Formulation

This drug may be formulated in DMSO

Stock Solution Storage

0 - 4 C for short term (days to weeks), or -20 C for long term (months).

HS Tariff Code

2934.99.03.00

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 618.86 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Concentration / Solvent Volume / Mass	1 mg	5 mg	10 mg
1 mM	1.15 mL	5.76 mL	11.51 mL
5 mM	0.23 mL	1.15 mL	2.3 mL
10 mM	0.12 mL	0.58 mL	1.15 mL
50 mM	0.02 mL	0.12 mL	0.23 mL

1: Jiang B, Han WL, Zhang QW, Zhang XQ, Ye WC. [Chemical constituents from the aerial roots of Ficus microcarpa]. Zhong Yao Cai. 2012 Jun;35(6):904-8. Chinese. PubMed PMID: 23236824. 2: Wei Y, Wang G, Zhang X, Wang Y, Ye W. [Studies on chemical constituents in roots of Helicteres angustifolia]. Zhongguo Zhong Yao Za Zhi. 2011 May;36(9):1193-7. Chinese. PubMed PMID: 21842648. 3: Pan MH, Chen CM, Lee SW, Chen ZT. Cytotoxic triterpenoids from the root bark of Helicteres angustifolia. Chem Biodivers. 2008 Apr;5(4):565-74. doi: 10.1002/cbdv.200890053. PubMed PMID: 18421748. 4: Otsuka H, Fujioka S, Komiya T, Goto M, Hiramatsu Y, Fujimura H. Studies on anti-inflammatory agents. V. A new anti-inflammatory constituent of Pyracantha crenulata roem. Chem Pharm Bull (Tokyo). 1981 Nov;29(11):3099-104. PubMed PMID: 7337925.