 Home > Encyclopedia > (2S)-N-[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2,5-diaminopentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]-4-methylpentanamide

(2S)-N-[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2,5-diaminopentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]-4-methylpentanamide

(2S)-N-[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2,5-diaminopentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]-4-methylpentanamide structure

CAS No:
102979-72-6
Formula:
C36H54N8O6S
Chemical Name:
(2S)-N-[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2,5-diaminopentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]-4-methylpentanamide
Synonyms:
6-Orn-substance P (6-11);substance P (6-11), Orn(6)-;substance P (6-11), ornithine(6)-;Substance P (6-11), orn(6)-;102979-72-6;6-Orn-substance P (6-11);Substance P (6-11), ornithine(6)-;CHEMBL23653;DTXSID30145599;L-Ornithyl-L-phenylalanyl-L-phenylalanylglycyl-L-leucyl-L-methioninamide;L-Methioninamide, L-ornithyl-L-phenylalanyl-L-phenylalanylglycyl-L-leucyl-

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(2S)-N-[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2,5-diaminopentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]-4-methylpentanamide Basic Attributes

Molecular Weight：

726.9 g/mol

Exact Mass：

726.38870265 g/mol

DSSTox ID：

DTXSID30145599

Characteristics

PSA：

266 Å²

Drug Information

MeSH Entry Terms：

6-Orn-substance P (6-11)

Computed Properties

Molecular Weight:726.9
XLogP3:1.2
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:23
Exact Mass:726.38870265
Monoisotopic Mass:726.38870265
Topological Polar Surface Area:266
Heavy Atom Count:51
Complexity:1120
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 3-methylbutanal; 1-bromo-2-methylpropane; aluminum hydroxide formula; nitrite formula; acetone formula; formula for ammonia sulfate

Guide of (2S)-N-[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2,5-diaminopentanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]-4-methylpentanamide

Basic Attributes
Characteristics
Drug Information
Computed Properties

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