Maytansinoid DM4

Basic Information

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CAS Number

799840-96-3

Molecular Formula

C39H56ClN3O10S

Molecular Weight

794.41 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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C[C@]12[C@@H](OC([C@@H](N(C(CCC(S)(C)C)=O)C)C)=O)CC(N(C)C3=C(Cl)C(OC)=CC(C/C(C)=C/C=C/[C@@H](OC)[C@@](N4)(O)C[C@@](OC4=O)([H])C(C)(C)[C@@]1(O2)[H])=C3)=O

InChI

InChI=1S/C39H56ClN3O10S/c1-22-13-12-14-27(50-11)39(48)21-29(52-35(47)41-39)37(5,6)34-38(7,53-34)28(51-33(46)23(2)42(8)30(44)15-16-36(3,4)54)20-31(45)43(9)25-18-24(17-22)19-26(49-10)32(25)40/h12-14,18-19,23,27-29,34,48,54H,15-17,20-21H2,1-11H3,(H,41,47)/b14-12+,22-13+/t23-,27+,28-,29-,34-,38-,39-/m0/s1

InChIKey

SVVGCFZPFZGWRG-OTKBOCOUSA-N

LogP

5.393200000000006

Topological Polar Surface Area

156.47 Å²

Hydrogen Bond Donor/Acceptor

2 / 13

Complexity

1480

Synonyms & References

English

DM-4
Maytansinoid dM4
N2'-Deacetyl-N2'-(4-mercapto-4-methyl-1-oxopentyl)-6-methylmaytansine

MDL Number

MFCD28144633

FAQ

What regulatory guidelines apply to Maytansinoid DM4 (CAS: 799840-96-3)?

Maytansinoid DM4 (CAS: 799840-96-3) is subject to various regulatory guidelines, including GHS classification, REACH regulations, and FDA/EPA requirements. It is important to comply with these regulations to ensure safe handling and use. GHS classification helps in understanding its hazards, while REACH requires registration and assessment of its environmental and health impacts. FDA and EPA regulations control its use in pharmaceuticals and environmental releases.

Are there alternatives to Maytansinoid DM4 (CAS: 799840-96-3) in its synthesis?

There are several alternatives to Maytansinoid DM4 (CAS: 799840-96-3) in its synthesis, including analogs like maytansinol and isomers like DM1 and DM2. Common alternative reagents include other cytotoxic agents such as auristatin, maytansinol, and their derivatives. These alternatives can be considered based on the specific requirements and conditions of the synthesis process.

What is the market or research trend for Maytansinoid DM4 (CAS: 799840-96-3)?

The market for Maytansinoid DM4 (CAS: 799840-96-3) is driven by its application in targeted cancer therapy. Research trends are focusing on its use in combination therapies and the development of more potent derivatives. Market demand is increasing due to its efficacy in treating various types of cancer. The trend is also towards more sustainable and cost-effective production methods.

How should waste containing Maytansinoid DM4 (CAS: 799840-96-3) be handled?

Waste containing Maytansinoid DM4 (CAS: 799840-96-3) should be handled according to regulatory guidelines. Collect it in appropriate containers, ensuring it is labeled with the correct hazard information. Incineration is a common method, but professional waste disposal services should be used for safe disposal. Environmental protection precautions include minimizing the release of the compound into the environment and following all local and national waste management regulations.