Metergotamine | CAS#22336-84-1 | ergotamine | peptide alkaloids

MedKoo Cat#: 534850 | Name: Metergotamine

Description:

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

Metergotamine (MY-25 or 1-methyl-ergotamine-bitartrate) is a derivative of ergotamine and belongs to peptide alkaloids.

Chemical Structure

Metergotamine

CAS#22336-84-1 (free base)

Theoretical Analysis

MedKoo Cat#: 534850

Name: Metergotamine

CAS#: 22336-84-1 (free base)

Chemical Formula: C34H37N5O5

Exact Mass: 595.2795

Molecular Weight: 595.70

Elemental Analysis: C, 68.55; H, 6.26; N, 11.76; O, 13.43

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 #

91000-52-1 (maleate) 16891-52-4 (hemitartrate) 22336-84-1 (free base)

Synonym

Metergotamine; 1-Methylergotamine; 22336-84-1; Metergotamina; Metergotaminum; MY-25; MY 25; MY25; 1-methyl-ergotamine-bitartrate

IUPAC/Chemical Name

(6aR,9R)-N-((2R,5S,10aS,10bS)-5-benzyl-10b-hydroxy-2-methyl-3,6-dioxooctahydro-8H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl)-4,7-dimethyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinoline-9-carboxamide maleate

InChi Key

SZUQJDJBJHBVBO-CTTKVJGISA-N

InChi Code

InChI=1S/C34H37N5O5/c1-33(32(42)39-27(15-20-9-5-4-6-10-20)31(41)38-14-8-13-28(38)34(39,43)44-33)35-30(40)22-16-24-23-11-7-12-25-29(23)21(18-36(25)2)17-26(24)37(3)19-22/h4-7,9-12,16,18,22,26-28,43H,8,13-15,17,19H2,1-3H3,(H,35,40)/t22-,26-,27+,28+,33-,34+/m1/s1

SMILES Code

[H][C@@]12CC3=CN(C)C4=C3C(C1=C[C@@H](C(N[C@]5(C(N6[C@H](C(N7CCC[C@]7([C@@]6(O5)O)[H])=O)CC8=CC=CC=C8)=O)C)=O)CN2C)=CC=C4

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

2934.99.9001

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 595.70 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: Alsaad SSM, Abu-Grain SHS, El-Kheir DYM. Preparedness of Dammam primary health care centers to deal with emergency cases. J Family Community Med. 2017 Sep-Dec;24(3):181-188. doi: 10.4103/jfcm.JFCM_5_17. PMID: 28932163; PMCID: PMC5596631.