Chemical Compound

13-[7-(4-aminobutyl)-13-{1-[10-(carbamoylmethyl)-16-{2-[3-(4-hydroxyphenyl)-2-{2-[2-(4-methyl-2-{3-methyl-2-[2-(3-methyl-2-{2-[(1-{2-[2-({1-[2-(2-oxobutanamido)but-2-enoyl]pyrrolidin-2-yl}formamido)propanamido]but-2-enoyl}pyrrolidin-2-yl)formamido]propanamido}pentanamido)propanamido]pentanamido}pentanamido)propanamido]propanamido}propanamido]-3-methylpentanamido}-7,13-bis[(4-hydroxyphenyl)methyl]-6,9,12,15-tetraoxo-1,2-dithia-5,8,11,14-tetraazacycloheptadecane-4-carbonyl]pyrrolidine-2-amido}-10-[(4-hydroxyphenyl)methyl]-14-methyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-amido]-10-(3-carbamimidamidopropyl)-7-methyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxylic acid

13-[7-(4-aminobutyl)-13-{1-[10-(carbamoylmethyl)-16-{2-[3-(4-hydroxyphenyl)-2-{2-[2-(4-methyl-2-{3-methyl-2-[2-(3-methyl-2-{2-[(1-{2-[2-({1-[2-(2-oxobutanamido)but-2-enoyl]pyrrolidin-2-yl}formamido)propanamido]but-2-enoyl}pyrrolidin-2-yl)formamido]propanamido}pentanamido)propanamido]pentanamido}pentanamido)propanamido]propanamido}propanamido]-3-methylpentanamido}-7,13-bis[(4-hydroxyphenyl)methyl]-6,9,12,15-tetraoxo-1,2-dithia-5,8,11,14-tetraazacycloheptadecane-4-carbonyl]pyrrolidine-2-amido}-10-[(4-hydroxyphenyl)methyl]-14-methyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-amido]-10-(3-carbamimidamidopropyl)-7-methyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxylic acid 结构式
Primary record

13-[7-(4-aminobutyl)-13-{1-[10-(carbamoylmethyl)-16-{2-[3-(4-hydroxyphenyl)-2-{2-[2-(4-methyl-2-{3-methyl-2-[2-(3-methyl-2-{2-[(1-{2-[2-({1-[2-(2-oxobutanamido)but-2-enoyl]pyrrolidin-2-yl}formamido)propanamido]but-2-enoyl}pyrrolidin-2-yl)formamido]propanamido}pentanamido)propanamido]pentanamido}pentanamido)propanamido]propanamido}propanamido]-3-methylpentanamido}-7,13-bis[(4-hydroxyphenyl)methyl]-6,9,12,15-tetraoxo-1,2-dithia-5,8,11,14-tetraazacycloheptadecane-4-carbonyl]pyrrolidine-2-amido}-10-[(4-hydroxyphenyl)methyl]-14-methyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-amido]-10-(3-carbamimidamidopropyl)-7-methyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxylic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177439939
SMILES
CCC(C)C(C(=O)NC(C)C(=O)NC(C(C)CC)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(C(C)CC)C(=O)NC2CSSCC(NC(=O)C(NC(=O)C(NC(=O)C(NC2=O)CC3=CC=C(C=C3)O)CC(=O)N)CC4=CC=C(C=C4)O)C(=O)N5CCCC5C(=O)NC6C(SSCC(NC(=O)C(NC(=O)C(NC6=O)CC7=CC=C(C=C7)O)CCCCN)C(=O)NC8CSSCC(NC(=O)C(NC(=O)C(NC8=O)CCCNC(=N)N)C)C(=O)O)C)NC(=O)C(C)NC(=O)C9CCCN9C(=O)C(=CC)NC(=O)C(C)NC(=O)C1CCCN1C(=O)C(=CC)NC(=O)C(=O)CC
Canonical SMILES
CC=C(NC(=O)C(=O)CC)C(=O)N1CCCC1C(=O)NC(C)C(=O)NC(=CC)C(=O)N1CCCC1C(=O)NC(C)C(=O)NC(C(=O)NC(C)C(=O)NC(C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(C(=O)NC1CSSCC(C(=O)N2CCCC2C(=O)NC2C(=O)NC(Cc3ccc(O)cc3)C(=O)NC(CCCCN)C(=O)NC(C(=O)NC3CSSCC(C(=O)O)NC(=O)C(C)NC(=O)C(CCCNC(=N)N)NC3=O)CSSC2C)NC(=O)C(Cc2ccc(O)cc2)NC(=O)C(CC(N)=O)NC(=O)C(Cc2ccc(O)cc2)NC1=O)C(C)CC)C(C)CC)C(C)CC

名称与同义词

  • Lacticin 3147A2
  • J2.434.121F
  • 1-[2-(2-Oxobutyrylamino)-2-butenoyl]-L-Pro-L-Ala-(2-amino*-2-butenoyl)-L-Pro-L-Ala-L-Ile-D-Ala-L-Ile-L-Leu-D-Ala-L-Ala-L-Tyr-L-Ile-L-Cys(1)-L-Tyr-L-Asn-L-Tyr-L-Cys(1)-L-Pro-[(3R)-3-methyl-L-Cys(2)-]L-Tyr-L-Lys-L-Cys(2)-L-Cys(3)-L-Arg-L-Ala-L-Cys(3)-OH
  • 13-[7-(4-aminobutyl)-13-{1-[10-(carbamoylmethyl)-16-{2-[3-(4-hydroxyphenyl)-2-{2-[2-(4-methyl-2-{3-methyl-2-[2-(3-methyl-2-{2-[(1-{2-[2-({1-[2-(2-oxobutanamido)but-2-enoyl]pyrrolidin-2-yl}formamido)propanamido]but-2-enoyl}pyrrolidin-2-yl)formamido]propanamido}pentanamido)propanamido]pentanamido}pentanamido)propanamido]propanamido}propanamido]-3-methylpentanamido}-7,13-bis[(4-hydroxyphenyl)methyl]-6,9,12,15-tetraoxo-1,2-dithia-5,8,11,14-tetraazacycloheptadecane-4-carbonyl]pyrrolidine-2-amido}-10-[(4-hydroxyphenyl)methyl]-14-methyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-amido]-10-(3-carbamimidamidopropyl)-7-methyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxylic acid