Sabadine

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MedKoo CAT#: 461684

CAS#: 124-80-1

Description: Sabadine is a crystalline alkaloid which is found in sabadilla seeds and acts as a pesticide.


Chemical Structure

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Sabadine
CAS# 124-80-1

Theoretical Analysis

MedKoo Cat#: 461684
Name: Sabadine
CAS#: 124-80-1
Chemical Formula: C29H47NO8
Exact Mass: 537.3302
Molecular Weight: 537.69
Elemental Analysis: C, 64.78; H, 8.81; N, 2.61; O, 23.80

Price and Availability

This product is not in stock, which may be available by custom synthesis. For cost-effective reason, minimum order is 1g (price is usually high, lead time is 2~3 months, depending on the technical challenge). Quote less than 1g will not be provided. To request quote, please email to sales @medkoo.com or click below button.
Note: Price will be listed if it is available in the future.

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Synonym: Sabadine;

IUPAC/Chemical Name: (3S,4S,4aS,6aR,6bR,8S,8aS,9R,9aS,12S,15aS,15bR,16aS,16bR)-4,6b,8,8a,9,15b-hexahydroxy-9,12,16b-trimethyltetracosahydrobenzo[4,5]indeno[1,2-h]pyrido[1,2-b]isoquinolin-3-yl acetate

InChi Key: IJZIXCZIZHENJV-ONCBQHFTSA-N

InChi Code: InChI=1S/C29H47NO8/c1-15-5-8-22-26(4,34)29(37)21(14-30(22)13-15)28(36)11-19-17(27(28,35)12-23(29)32)6-7-18-24(33)20(38-16(2)31)9-10-25(18,19)3/h15,17-24,32-37H,5-14H2,1-4H3/t15-,17+,18+,19-,20-,21-,22-,23-,24-,25-,26+,27+,28+,29-/m0/s1

SMILES Code: [H][C@@]12[C@H](O)[C@@H](OC(C)=O)CC[C@]1(C)[C@@]3([H])C[C@@]4(O)[C@]5([H])CN6C[C@@H](C)CC[C@]([H])6[C@@](C)(O)[C@@]5(O)[C@@H](O)C[C@@]4(O)[C@]3([H])CC2

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

Preparing Stock Solutions

The following data is based on the product molecular weight 537.69 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

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1: Prestes OD, Padilla-Sánchez JA, Romero-González R, López Grio S, Garrido Frenich A, Martínez-Vidal JL. Comparison of several extraction procedures for the determination of biopesticides in soil samples by ultrahigh pressure LC-MS/MS. J Sep Sci. 2012 Apr;35(7):861-8. doi: 10.1002/jssc.201101057. PubMed PMID: 22532355.

2: KUPCHAN SM, GRUENFELD N, KATSUI N. VERATRUM ALKALOIDS. XLIX. THE STRUCTURES AND CONFIGURATIONS OF SABINE AND SABADINE. J Med Pharm Chem. 1962 Jul;91:690-714. PubMed PMID: 14056401.

3: MOEHRLE H, AUTERHOFF H. [The constitution of sabadine. X. Veratrin-veratrum alkaloids]. Arch Pharm Ber Dtsch Pharm Ges. 1959 Jul;64:337-40. German. PubMed PMID: 13848665.