Molecules/Cemdisiran, terminal sugar modification-

Cemdisiran, terminal sugar modification-

[(2S,4R)-1-[12-[[1,3-bis[3-[3-[5-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]-2-[[3-[3-[5-[(2R,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentanoylamino]propylamino]-3-oxopropoxy]methyl]propan-2-yl]amino]-12-oxododecanoyl]-4-hydroxypyrrolidin-2-yl]methyl dihydrogen phosphate

C78H140N11O34P1807.00 g/molCID 126480325

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Molecular Identity

Cemdisiran, terminal sugar modification-

PubChem CID: 126480325

2D Structure

Properties

C₇₈H₁₄₀N₁₁O₃₄P

Molecular Formula

1807.00

Molecular Weight

g/mol

1805.9302

Exact Mass

-8

XLogP

Drug-like (Lipinski: < 5)

663

TPSA

May have limited oral absorption

H-Bond Donors

H-Bond Acceptors

2950

Complexity

SMILES

Canonical SMILES

SMILES: CC(=O)NC1C(C(C(OC1OCCCCC(=O)NCCCNC(=O)CCOCC(COCCC(=O)NCCCNC(=O)CCCCOC2C(C(C(C(O2)CO)O)O)NC(=O)C)(COCCC(=O)NCCCNC(=O)CCCCOC3C(C(C(C(O3)CO)O)O)NC(=O)C)NC(=O)CCCCCCCCCCC(=O)N4CC(CC4COP(=O)(O)O)O)CO)O)O

Isomeric SMILES

SMILES: CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@H]1OCCCCC(=O)NCCCNC(=O)CCOCC(COCCC(=O)NCCCNC(=O)CCCCO[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)NC(=O)C)(COCCC(=O)NCCCNC(=O)CCCCO[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)NC(=O)C)NC(=O)CCCCCCCCCCC(=O)N4C[C@@H](C[C@H]4COP(=O)(O)O)O)CO)O)O

Synonyms(20)

Cemdisiran, terminal sugar modification-1436858-07-9CQQ59545BVUNII-CQQ59545BVInclisiran, terminal sugar modification-RefChem:200106Cemdisiran1639264-46-2orb1982842orb3032967SCHEMBL31244579GLXC-26019EX-A8119Cemdisiran, terminal sugar modificationDA-62205

Data from PubChem (NCBI)

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Molecular Structure

Cemdisiran, terminal sugar modification-

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Source: PubChem

Drug Network

Trials and conditions connected to Cemdisiran, terminal sugar modification-

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