Chemical Compound

N-[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-butan-2-yl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide

CAS Registry Number 113-78-0
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N-[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-butan-2-yl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide 结构式
Primary record

N-[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-butan-2-yl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide

库存
3,382 克
纯度
98.7 %
CAS
113-78-0

化合物标识与属性

CAS
113-78-0
PubChem CID
8229
SMILES
CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NC(CSSCCC(=O)NC(C(=O)N1)CC2=CC=C(C=C2)O)C(=O)N3CCCC3C(=O)NC(CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N
Canonical SMILES
CCC(C)C1NC(=O)C(Cc2ccc(O)cc2)NC(=O)CCSSCC(C(=O)N2CCCC2C(=O)NC(CC(C)C)C(=O)NCC(N)=O)NC(=O)C(CC(N)=O)NC(=O)C(CCC(N)=O)NC1=O

名称与同义词

  • Deaminooxytocin
  • DEMOXYTOCIN
  • Sandopart
  • Demossitocina
  • Demoxytocinum
  • Demoxitocina
  • Demoxytocine
  • desaminooxytocin
  • Demoxytocin [INN]
  • Demossitocina [DCIT]
  • Demoxytocin (INN)
  • Demoxytocine [INN-French]
  • Demoxytocinum [INN-Latin]
  • AC1L1QJY
  • AC1Q5JBP
  • Demoxitocina [INN-Spanish]
  • (Deamino-Cys?)-Oxytocin
  • 1-mercaptopropionateoxytoxin
  • UNII-2N9HM3X95F
  • SCHEMBL38443
  • C6H12OS
  • ODA 914
  • SCHEMBL20456238
  • EINECS 204-034-9
  • CID8229
  • ODA-914
  • 1-(3-Mercaptopropionic acid)-oxytocin
  • C43H65N11O12S2
  • AR-1B9627
  • MFCD00867797
  • 1-(3-mercaptopropanoic acid)oxytocin
  • C43-H65-N11-O12-S2
  • LS-172209
  • D07228
  • 113-78-0
  • 1-{[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-(butan-2-yl)-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}prolylleucylglycinamide
  • 1155-48-2
  • N-[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-butan-2-yl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide