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Chemical structure of Substance P, Free Acid

GC37699

Substance P, Free Acid

Also known as 2-[[2-[[2-[[2-[[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-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]-4-methylpentanoyl]amino]-4-methylsulfanylbutanoic acid

Substance P, Free Acid is a native substance P analog, but shows no biological activity of substance P

ChemicalCAS71977-09-8MW1348.61FormulaC63H97N17O14S
CAS number
71977-09-8
Molecular weight
1348.61
Formula
C63H97N17O14S
Solubility
Soluble in DMSO
InChIKey
XHWDVRRNQHMAPE-UHFFFAOYSA-N
Catalogue number
GC37699
Brand
GLPBIO
Computed properties PubChem CID 5048481 · XLogP -3.9 · TPSA 539 Ų · H-bond donors 15
XLogP
-3.9
TPSA
539 Ų
H-bond donors
15
H-bond acceptors
18
Rotatable bonds
42
Heavy atoms
95

SMILES CC(C)CC(C(=O)NC(CCSC)C(=O)O)NC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CCC(=O)N)NC(=O)C(CCC(=O)N)NC(=O)C3CCCN3C(=O)C(CCCCN)NC(=O)C4CCCN4C(=O)C(CCCN=C(N)N)N

Computed descriptors from PubChem (CID 5048481), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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