Chemical Compound

M1(Dns)-1alpha

M1(Dns)-1alpha chemical structure
Primary Record

M1(Dns)-1alpha

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177497455
SMILES
C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](CSCNC(=O)C)C(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C
Canonical SMILES
CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](CSCNC(C)=O)C(N)=O)C(C)C

Names & Synonyms

  • M1(Dns)-1alpha
  • J1.152.147I
  • (3S)-3-{[(1S)-5-amino-1-{[(1S)-1-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-1-{[(1S)-1-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-1-{[(1S)-5-amino-1-{[(1S)-4-carbamimidamido-1-({[({[(1R)-1-carbamoyl-2-[(acetamidomethyl)sulfanyl]ethyl]carbamoyl}methyl)carbamoyl]methyl}carbamoyl)butyl]carbamoyl}pentyl]carbamoyl}-3-methylbutyl]carbamoyl}pentyl]carbamoyl}-4-carbamimidamidobutyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}-3-methylbutyl]carbamoyl}pentyl]carbamoyl}-2-methylpropyl]carbamoyl}ethyl]carbamoyl}pentyl]carbamoyl}-3-[(2S)-2-[(2S)-3-carbamoyl-2-[(2S)-3-carbamoyl-2-[5-(dimethylamino)naphthalene-1-sulfonamido]propanamido]propanamido]-4-(methylsulfanyl)butanamido]propanoic acid