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Structure

Scyliorhinin i(9ci)

CAS
103425-21-4
Catalog Number
ACM103425214
Category
Other Products
Molecular Weight
1218.47
Molecular Formula
C59H87N13O13S

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Specification

Synonyms
SHARK SUBSTANCE P RELATED PEPTIDE;SCY 1;SCYLIORHININ I;SCYLIORHININ I AMIDE (DOGFISH);ALA-LYS-PHE-ASP-LYS-PHE-TYR-GLY-LEU-MET-NH2;AKFDKFYGLM;H-ALA-LYS-PHE-ASP-LYS-PHE-TYR-GLY-LEU-MET-NH2;H-ALA-LYS-PHE-ASP-LYS-PHE-TYR-GLY-LEU-MET-OH
IUPAC Name
(3S)-4-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxohexan-2-yl]a
Canonical SMILES
CC(C)CC(C(=O)NC(CCSC)C(=O)N)NC(=O)CNC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CCCCN)NC(=O)C(CC(=O)O)NC(=O)C(CC3=CC=CC=C3)NC(=O)C(CCCCN)NC(=O)C(C)N
InChI Key
LSFZLJJVGIYLDA-SRYPMHJGSA-N
Boiling Point
1590.2ºC at 760 mmHg
Flash Point
915.5ºC
Density
1.264 g/cm³
Exact Mass
1217.63000
H-Bond Acceptor
16
H-Bond Donor
15
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