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(2S,3S,4R,5R,6R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[(2S,3R,4R,5S)-3-acetamido-4-hydroxy-6-methyl-5-[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2-hydroxy-5-oxocyclopenten-1-yl)carbamoyl]oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4-carbamoyloxy-6-[[(2R)-2-carboxy-2-[(2E,6E,13E)-3,8,8,14,18-pentamethyl-11-methylidenenonadeca-2,6,13,17-tetraenoxy]ethoxy]-hydroxyphosphoryl]oxy-3-hydroxy-3-methyloxane-2-carboxylic acid

(2S,3S,4R,5R,6R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[(2S,3R,4R,5S)-3-acetamido-4-hydroxy-6-methyl-5-[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2-hydroxy-5-oxocyclopenten-1-yl)carbamoyl]oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4-carbamoyloxy-6-[[(2R)-2-carboxy-2-[(2E,6E,13E)-3,8,8,14,18-pentamethyl-11-methylidenenonadeca-2,6,13,17-tetraenoxy]ethoxy]-hydroxyphosphoryl]oxy-3-hydroxy-3-methyloxane-2-carboxylic acid | CAS No. 11015-37-5

(2S,3S,4R,5R,6R)-5-[(2S,3R,4R,5S,6R)-3-acetamido-5-[(2S,3R,4R,5S)-3-acetamido-4-hydroxy-6-methyl-5-[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2-hydroxy-5-oxocyclopenten-1-yl)carbamoyl]oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4-carbamoyloxy-6-[[(2R)-2-carboxy-2-[(2E,6E,13E)-3,8,8,14,18-pentamethyl-11-methylidenenonadeca-2,6,13,17-tetraenoxy]ethoxy]-hydroxyphosphoryl]oxy-3-hydroxy-3-methyloxane-2-carboxylic acid

Basic Information

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CAS Number

11015-37-5

Molecular Formula

C69H107N4O35P

Molecular Weight

1583.6 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Insecticides

Polymers and Plastics Thermoplastics Polyolefins

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Density

1.47

Refractive Index

1.615

SMILES

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CC1C(C(C(C(O1)OC2C(OC(C(C2O)NC(=O)C)OC3C(C(C(OC3OP(=O)(O)OCC(C(=O)O)OCC=C(C)CCC=CC(C)(C)CCC(=C)CC=C(C)CCC=C(C)C)C(=O)O)(C)O)OC(=O)N)COC4C(C(C(C(O4)CO)O)O)O)NC(=O)C)O)OC5C(C(C(C(O5)C(=O)NC6=C(CCC6=O)O)O)O)O

InChI

InChI=1S/C69H107N4O35P/c1-30(2)15-14-17-31(3)18-19-33(5)22-25-68(9,10)24-13-12-16-32(4)23-26-96-41(60(88)89)29-98-109(94,95)108-66-56(57(107-67(70)92)69(11,93)58(106-66)61(90)91)105-63-44(72-36(8)76)47(81)54(40(101-63)28-97-64-51(85)48(82)45(79)39(27-74)100-64)103-62-43(71-35(7)75)46(80)53(34(6)99-62)102-65-52(86)49(83)50(84)55(104-65)59(87)73-42-37(77)20-21-38(42)78/h13,15,18,23-24,34,39-41,43-58,62-66,74,77,79-86,93H,5,12,14,16-17,19-22,25-29H2,1-4,6-11H3,(H2,70,92)(H,71,75)(H,72,76)(H,73,87)(H,88,89)(H,90,91)(H,94,95)/b24-13+,31-18+,32-23+/t34?,39-,40-,41-,43-,44-,45-,46-,47-,48+,49+,50-,51-,52-,53-,54-,55+,56-,57-,58-,62+,63+,64-,65-,66-,69+/m1/s1

InChIKey

PERZMHJGZKHNGU-XIGAONJHSA-N

LogP

-1.4284000000000057

Topological Polar Surface Area

601.8800000000001 Å²

Hydrogen Bond Donor/Acceptor

19 / 39

Complexity

3370

Safety Information

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GHS Hazard Pictograms

H413

Hazard Statement

H413 May cause long lasting harmful effects to aquatic life
Hazardous to the aquatic environment, long-term hazard

Toxicity

LD50 in mice (mg/kg): >2000 orally, s.c. and i.p.; 1400 i.v. (Lindner, Wallhuser)

Synonyms & References

English

Flavomycin
Moenomycin Complex (>80%) (Mixture of Moenomycin A, Moenomycin A12, Moenomycin C1, Moenomycin C3, Moenomycin C4)
Flavophospholipol
(2S,3S,4R,5R,6R)-5-(((2S,3R,4R,5S,6R)-3-Acetamido-5-(((2S,3R,4R,5S)-3-acetamido-4-hydroxy-6-methyl-5-(((2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-((2-hydroxy-5-oxocyc
Moenomycin Complex (~5-10% Over CaCO3)
AC-37087
MFCD01742468
11015-37-5
KS-5173
AKOS016339637
MOENOMYCIN
moenomycin a
menomycin
BAMBERMYCIN
BAMBERMYCINS
flavophospholipol
Flavomycin Premix
Moenomycin Complex
Bambermycine
Moenomycine
YUHUNJI
Flavomycine

MDL Number

MFCD01742468

FAQ

What regulatory guidelines apply to [compound name] (CAS: 11015-37-5)?

The regulation of [compound name] (CAS: 11015-37-5) is primarily guided by the GHS (Globally Harmonized System of Classification and Labelling of Chemicals) for hazard communication. Additionally, REACH (Registration, Evaluation, Authorization and Restriction of Chemicals) in Europe and FDA/EPA in the United States require extensive safety data and environmental impact assessments. Manufacturers and users must comply with these regulations to ensure safe handling, storage, and disposal of the compound.

Are there alternatives to [compound name] (CAS: 11015-37-5) in synthesis?

While [compound name] (CAS: 11015-37-5) is a complex compound, there are alternative reagents and synthesis methods that can be used. These include simpler analogs and isomers, such as related phosphoramidates and cyclic esters. Alternative approaches like click chemistry and bio-orthogonal reactions can also provide effective routes to similar functionalities without the complexity of [compound name].

What is the market or research trend for [compound name] (CAS: 11015-37-5)?

The market trend for [compound name] (CAS: 11015-37-5) is currently driven by its potential applications in pharmaceuticals and biotechnology. Research is focusing on its use as a potent inhibitor in various biological pathways. Market dynamics show increasing interest due to its unique chemical structure and potential therapeutic value. However, price trends are unpredictable and subject to supply and demand fluctuations.

How should waste containing [compound name] (CAS: 11015-37-5) be handled?

Waste containing [compound name] (CAS: 11015-37-5) should be handled with caution due to its complex chemical structure. It is advisable to collect waste in a sealed, non-reactive container and dispose of it through professional waste disposal services. Incineration is a common method, but environmental protection precautions must be taken to ensure minimal impact on the environment. Always consult local regulations and guidelines for safe disposal methods.