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Chemical structure of Substance P 1-7

GC37696

Substance P 1-7

Also known as 2-[[5-amino-2-[[5-amino-2-[[1-[6-amino-2-[[1-[2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-3-phenylpropanoic acid

Substance P 1-7 is a fragment of the neuropeptide, substance P (SP)

ChemicalCAS68060-49-1MW900.04FormulaC41H65N13O10
CAS number
68060-49-1
Molecular weight
900.04
Formula
C41H65N13O10
Solubility
Soluble in DMSO
InChIKey
KPHDBQWTCKBKIL-UHFFFAOYSA-N
Catalogue number
GC37696
Brand
GLPBIO
Computed properties PubChem CID 3368303 · XLogP -6.1 · TPSA 397 Ų · H-bond donors 11
XLogP
-6.1
TPSA
397 Ų
H-bond donors
11
H-bond acceptors
13
Rotatable bonds
27
Heavy atoms
64

SMILES C1CC(N(C1)C(=O)C(CCCN=C(N)N)N)C(=O)NC(CCCCN)C(=O)N2CCCC2C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)N)C(=O)NC(CC3=CC=CC=C3)C(=O)O

Computed descriptors from PubChem (CID 3368303), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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