Tachyplesin I | CAS No. 118231-04-2

Tachyplesin I

Basic Information

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CAS Number

118231-04-2

Molecular Formula

C99H151N35O19S4

Molecular Weight

2263.8 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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CCC(C)C1C(=O)NC2CSSCC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)N1)CCCNC(=N)N)CC3=CC=C(C=C3)O)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(CSSCC(NC(=O)C(NC(=O)C(NC(=O)C(NC2=O)CC4=CC=C(C=C4)O)CCCNC(=N)N)CCCNC(=N)N)C(=O)NC(CCCNC(=N)N)C(=O)N)NC(=O)C(CC5=CNC6=CC=CC=C65)NC(=O)C(CCCCN)N)CC7=CC=CC=C7)CCCNC(=N)N)C(C)C

InChI

InChI=1S/C99H151N35O19S4/c1-5-53(4)78-94(153)132-75-51-157-156-50-74(91(150)127-69(43-55-28-32-58(135)33-29-55)85(144)121-64(24-14-38-114-96(105)106)81(140)119-47-76(137)133-78)131-93(152)77(52(2)3)134-84(143)67(27-17-41-117-99(111)112)124-86(145)68(42-54-18-7-6-8-19-54)126-90(149)73(130-88(147)71(125-80(139)61(101)21-11-12-36-100)45-57-46-118-62-22-10-9-20-60(57)62)49-155-154-48-72(89(148)120-63(79(102)138)23-13-37-113-95(103)104)129-83(142)66(26-16-40-116-98(109)110)122-82(141)65(25-15-39-115-97(107)108)123-87(146)70(128-92(75)151)44-56-30-34-59(136)35-31-56/h6-10,18-20,22,28-35,46,52-53,61,63-75,77-78,118,135-136H,5,11-17,21,23-27,36-45,47-51,100-101H2,1-4H3,(H2,102,138)(H,119,140)(H,120,148)(H,121,144)(H,122,141)(H,123,146)(H,124,145)(H,125,139)(H,126,149)(H,127,150)(H,128,151)(H,129,142)(H,130,147)(H,131,152)(H,132,153)(H,133,137)(H,134,143)(H4,103,104,113)(H4,105,106,114)(H4,107,108,115)(H4,109,110,116)(H4,111,112,117)/t53-,61-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,77-,78-/m0/s1

InChIKey

ZJQFYZCNRTZAIM-PMXBASNASA-N

LogP

-6.012049999999883

Topological Polar Surface Area

926.4799999999997 Å²

Hydrogen Bond Donor/Acceptor

45 / 54

Complexity

4720

Synonyms & References

English

CHEMBL4544197
KWCFRVCYRGICYRRCR-NH2
Tachyplesin
CS-0065054
HY-P1632
Tachyplesin I (reduced), cyclic (3.16),(7.12)-bis(disulfide)
NH2-Lys-Trp-Cys(x2)-Phe-Arg-Val-Cys(x1)-Tyr-Arg-Gly-Ile-Cys(x1)-Tyr-Arg-Arg-Cys(x2)-Arg-NH2
Tachyplesin I
Tachyplesin I (Tachypleus tridentatus)
tachyplesin peptide, Tachypleus tridentatus
118231-04-2
Tachyplesin I (9CI)
H-LYS-TRP-CYS-PHE-ARG-VAL-CYS-TYR-ARG-GLY-ILE-CYS-TYR-ARG-ARG-CYS-ARG-NH2
Lipopolysaccharide-binding peptide
tachyplesin peptide,Tachypleus tridentatus
Tachyplesin peptide, Tachypleus tridentatus