substance P (5-11), Arg(5)-Trp(7,9)-

(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-N-[(2R)-1-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]pentanediamide

Also Known As: SP(5-11)-Att|Substance P (5-11), arg(5)-trp(7,9)-|5-Arg-7,9-trp-substance P (5-11)|5-Arginyl-7,9-tryptophan-substance P (5-11)|Substance P (5-11), arginyl(5)-tryptophan(7,9)-|n5-(diaminomethylidene)-l-ornithyl-l-glutaminyl-d-tryptophyl-l-phenylalanyl-d-tryptophyl-l-leucyl-l-methioninamide|L-Methioninamide, L-arginyl-L-glutaminyl-D-tryptophyl-L-phenylalanyl-D-tryptophyl-L-leucyl-|(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-N-[(2R)-1-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]pentanediamide

Molecular Formula	C53H72N14O8S
Molecular Weight	1064.5378 g/mol
LogP	1.7
Topological Polar Surface Area	408.0 Ų
Hydrogen Bond Donors	13
Hydrogen Bond Acceptors	11
Rotatable Bonds	31
Exact Mass	1064.5378
Monoisotopic Mass	1064.5378
Heavy Atoms	76
Complexity	1970.0

Chemical Identifiers

CAS Number	35341-96-9
SMILES	CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@@H](CC4=CNC5=CC=CC=C54)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCN=C(N)N)N
InChIKey	IFVXUPDHIFMAJT-YAFSIBTLSA-N