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MedKoo Cat#: 597902 | Name: Khasianine

Description:

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

Khasianine is a steroidal alkaloid.

Chemical Structure

Khasianine
Khasianine
CAS#32449-98-2

Theoretical Analysis

MedKoo Cat#: 597902

Name: Khasianine

CAS#: 32449-98-2

Chemical Formula: C39H63NO11

Exact Mass: 721.4401

Molecular Weight: 721.92

Elemental Analysis: C, 64.89; H, 8.80; N, 1.94; O, 24.38

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.
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Related CAS #
No Data
Synonym
Khasianine; NSC 376459; NSC-376459; NSC376459;
IUPAC/Chemical Name
(2S,3R,4R,5R,6S)-2-(((2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-(((4R,5'R,6aR,6bS,8aS,8bR,9S,10S,11aS,12aS,12bS)-5',6a,8a,9-tetramethyl-1,3,4,5,6,6a,6b,7,8,8a,8b,9,11a,12,12a,12b-hexadecahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-piperidin]-4-yl)oxy)tetrahydro-2H-pyran-3-yl)oxy)-6-methyltetrahydro-2H-pyran-3,4,5-triol
InChi Key
KRQDMAXNTWLTDZ-QRLCHWRASA-N
InChi Code
InChI=1S/C39H63NO11/c1-18-8-13-39(40-16-18)19(2)28-26(51-39)15-25-23-7-6-21-14-22(9-11-37(21,4)24(23)10-12-38(25,28)5)48-36-33(46)31(44)34(27(17-41)49-36)50-35-32(45)30(43)29(42)20(3)47-35/h6,18-20,22-36,40-46H,7-17H2,1-5H3/t18-,19+,20+,22-,23-,24+,25+,26+,27-,28+,29+,30-,31-,32-,33-,34-,35+,36-,37+,38+,39+/m1/s1
SMILES Code
O[C@H]([C@H]([C@@H]([C@@H](CO)O1)O[C@H]2[C@@H]([C@@H]([C@H]([C@H](C)O2)O)O)O)O)[C@@H]1O[C@@H]3CC[C@]4(C)[C@@]5([H])CC[C@]6(C)[C@]7([H])[C@@]([H])(O[C@]8(NC[C@H](C)CC8)[C@H]7C)C[C@@]6([H])[C@]5([H])CC=C4C3
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

Preparing Stock Solutions

The following data is based on the product molecular weight 721.92 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.

Recalculate based on batch purity %
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: Chang LC, Tsai TR, Wang JJ, Lin CN, Kuo KW. The rhamnose moiety of solamargine plays a crucial role in triggering cell death by apoptosis. Biochem Biophys Res Commun. 1998 Jan 6;242(1):21-5. PubMed PMID: 9439603. 2: Li QD, Jiang HF, Chen L, Zhang FL, Shi BJ. [Steroidal Glycoside Constituents from Solanum cumingii]. Zhong Yao Cai. 2015 Jun;38(6):1206-8. Chinese. PubMed PMID: 26762061. 3: Shanker K, Gupta S, Srivastava P, Srivastava SK, Singh SC, Gupta MM. Simultaneous determination of three steroidal glycoalkaloids in Solanum xanthocarpum by high performance thin layer chromatography. J Pharm Biomed Anal. 2011 Feb 20;54(3):497-502. doi: 10.1016/j.jpba.2010.09.025. Epub 2010 Sep 29. PubMed PMID: 20965683. 4: Yuan H, Chen Y, Cai B, Jia X, Chen Y. [Simultaneous determination of three steroidal alkaloids from Solanum Nigrum by RP-HPLC]. Zhongguo Zhong Yao Za Zhi. 2011 Jun;36(12):1630-2. Chinese. PubMed PMID: 22007549. 5: Akter R, Uddin SJ, Tiralongo J, Grice ID, Tiralongo E. A New Cytotoxic Steroidal Glycoalkaloid from the Methanol Extract of Blumea lacera Leaves. J Pharm Pharm Sci. 2015;18(4):616-33. PubMed PMID: 26626252. 6: Ripperger H, Porzel A. Steroidal alkaloid glycosides from Solanum suaveolens. Phytochemistry. 1997 Dec;46(7):1279-82. PubMed PMID: 9423293. 7: Regerat F, Texier O, Barthomeuf C, Fraisse D. Microbiological conversions of solamargine. Pharm Acta Helv. 1994 Jan;68(3):169-71. PubMed PMID: 8121925. 8: Puri R, Wong TC, Puri RK. 1H- and 13C-nmr assignments and structural determination of a novel glycoalkaloid from Solanum platanifolium. J Nat Prod. 1994 May;57(5):587-96. PubMed PMID: 8064291. 9: Gan KH, Lin CN, Won SJ. Cytotoxic principles and their derivatives of Formosan Solanum plants. J Nat Prod. 1993 Jan;56(1):15-21. PubMed PMID: 8450317. 10: Regerat F, Pourrat H, Texier O, Pourrat A. [Preparation of beta 2 solamargine by fermentation]. Ann Pharm Fr. 1984;42(5):473-8. French. PubMed PMID: 6535423. 11: Gu XY, Shen XF, Wang L, Wu ZW, Li F, Chen B, Zhang GL, Wang MK. Bioactive steroidal alkaloids from the fruits of Solanum nigrum. Phytochemistry. 2018 Mar;147:125-131. doi: 10.1016/j.phytochem.2017.12.020. Epub 2018 Jan 5. PubMed PMID: 29306798.