substance P

Chemical data

Formula

C63H98N18O13S

Molecular weight

1347.6 g/mol

IUPAC name

(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-1-[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-N-[(2S)-5-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]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]pentanediamide

SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)CNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCCN)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CCCN=C(N)N)N

InChIKey

ADNPLDHMAVUMIW-CUZNLEPHSA-N

XLogP

-2.3

Polar surface area

544 Ų

H-bond donors

15

H-bond acceptors

17

Formal charge

0

via PubChem

• Substance P.Pharmacological reviews · 1983
• The Regenerative Potential of Substance P.International journal of molecular sciences · 2022
• Substance P.Vitamins and hormones · 1977
• Substance P.Life sciences · 1974
• Substance P.British medical bulletin · 1982

via PubMed

Wikidata facts

Mass

1346.728146

via Wikidata · CC0