L-Histidine,glycyl-L-seryl-L-alanyl-L-Lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-l-asparaginyl-

CAS

94245-80-4

Catalog Number

ACM94245804

Category

Other Products

Molecular Weight

1545.7

Molecular Formula

C₆₆H₁₀₈N₂₂O₂₁

MSDS COA Spec Sheet

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Specification

Synonyms

GLY-SER-ALA-LYS-VAL-ALA-PHE-SER-ALA-ILE-ARG-SER-THR-ASN-HIS;H-GLY-SER-ALA-LYS-VAL-ALA-PHE-SER-ALA-ILE-ARG-SER-THR-ASN-HIS-OH;(DES-SER1)-CEREBELLIN

IUPAC Name

(2S)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-hydroxypropanoyl]amino]propanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]propan

Canonical SMILES

CCC(C)C(C(=O)NC(CCCN=C(N)N)C(=O)NC(CO)C(=O)NC(C(C)O)C(=O)NC(CC(=O)N)C(=O)NC(CC1=CN=CN1)C(=O)O)NC(=O)C(C)NC(=O)C(CO)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(C)NC(=O)C(C(C)C)NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(CO)NC(=O)CN

InChI Key

GWKLULAHRJELIF-ZSHGYWJLSA-N

Exact Mass

1544.81000

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl?

The molecular formula is C66H108N22O21.

When was L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl created?

It was created on February 16, 2015.

What is the computed IUPAC name of L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl?

The computed IUPAC name is (2S)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[(2-aminoacetyl)amino]-3-hydroxypropanoyl]amino]propanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]amino]propanoyl]amino]pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid.

What is the InChI of L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl?

The InChI is InChI=1S/C66H108N22O21/c1-9-32(4)50(63(106)80-40(19-15-21-73-66(70)71)55(98)84-46(29-91)61(104)88-51(36(8)92)64(107)82-42(24-47(69)93)58(101)83-43(65(108)109)23-38-26-72-30-74-38)87-54(97)35(7)76-60(103)45(28-90)85-57(100)41(22-37-16-11-10-12-17-37)81-53(96)34(6)77-62(105)49(31(2)3)86-56(99)39(18-13-14-20-67)79-52(95)33(5)75-59(102)44(27-89)78-48(94)25-68/h10-12,16-17,26,30-36,39-46,49-51,89-92H,9,13-15,18-25,27-29,67-68H2,1-8H3,(H2,69,93)(H,72,74)(H,75,102)(H,76,103)(H,77,105)(H,78,94)(H,79,95)(H,80,106)(H,81,96)(H,82,107)(H,83,101)(H,84,98)(H,85,100)(H,86,99)(H,87,97)(H,88,104)(H,108,109)(H4,70,71,73)/t32-,33-,34-,35-,36+,39-,40-,41-,42-,43-,44-,45-,46-,49-,50-,51-/m0/s1.

What is the InChIKey of L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl?

The InChIKey is GWKLULAHRJELIF-ZSHGYWJLSA-N.

What is the canonical SMILES of L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl?

The canonical SMILES is CCC(C)C(C(=O)NC(CCCN=C(N)N)C(=O)NC(CO)C(=O)NC(C(C)O)C(=O)NC(CC(=O)N)C(=O)NC(CC1=CN=CN1)C(=O)O)NC(=O)C(C)NC(=O)C(CO)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(C)NC(=O)C(C(C)C)NC(=O)C(CCCCN)NC(=O)C(C)NC(=O)C(CO)NC(=O)CN.

What is the molecular weight of L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl?

The molecular weight is 1545.7 g/mol.

What is the XLogP3-AA value of L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl?

The XLogP3-AA value is -10.

How many hydrogen bond donor counts are there in L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl?

There are 25 hydrogen bond donor counts.

What is the topological polar surface area of L-Histidine,glycyl-L-seryl-L-alanyl-L-lysyl-L-valyl-L-alanyl-L-phenylalanyl-L-seryl-L-alanyl-L-isoleucyl-L-arginyl-L-seryl-L-threonyl-L-asparaginyl?

The topological polar surface area is 714 ?2.