Chemical Compound

Methyl 3-((9aR)-8-(((1S,3''R,6''R,7''R,11''S,12''R)-6-chloro-7''-hydroxy-11'',12''-dimethyl-13'',13''-dioxido-15''-oxo-3,4-dihydro-2H-spiro[naphthalene-1,22-[20]oxa[13]thia[1,14]diazatetracyclo[14.7.2.0˜3,6˜.0˜19,24˜]pentacosa[16,18,24]trien]-7''-yl)methyl)octahydro-2H-pyrazino[1,2-a]pyrazin-2-yl)propanoate

Methyl 3-((9aR)-8-(((1S,3''R,6''R,7''R,11''S,12''R)-6-chloro-7''-hydroxy-11'',12''-dimethyl-13'',13''-dioxido-15''-oxo-3,4-dihydro-2H-spiro[naphthalene-1,22-[20]oxa[13]thia[1,14]diazatetracyclo[14.7.2.0˜3,6˜.0˜19,24˜]pentacosa[16,18,24]trien]-7''-yl)methyl)octahydro-2H-pyrazino[1,2-a]pyrazin-2-yl)propanoate 结构式
Primary record

Methyl 3-((9aR)-8-(((1S,3''R,6''R,7''R,11''S,12''R)-6-chloro-7''-hydroxy-11'',12''-dimethyl-13'',13''-dioxido-15''-oxo-3,4-dihydro-2H-spiro[naphthalene-1,22-[20]oxa[13]thia[1,14]diazatetracyclo[14.7.2.0˜3,6˜.0˜19,24˜]pentacosa[16,18,24]trien]-7''-yl)methyl)octahydro-2H-pyrazino[1,2-a]pyrazin-2-yl)propanoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
166595726
SMILES
C[C@H]1CCC[C@@]([C@@H]2CC[C@H]2CN3C[C@@]4(CCCC5=C4C=CC(=C5)Cl)COC6=C3C=C(C=C6)C(=O)NS(=O)(=O)[C@@H]1C)(CN7CCN8CCN(CC8C7)CCC(=O)OC)O
Canonical SMILES
COC(=O)CCN1CCN2CCN(C[C@@]3(O)CCC[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c4ccc5c(c4)N(C[C@@H]4CC[C@H]43)C[C@@]3(CCCc4cc(Cl)ccc43)CO5)CC2C1

名称与同义词

  • CHEMBL5839302
  • BDBM533920
  • US11224601, Example 499
  • US11224601, Example 500
  • Methyl 3-((9aR)-8-(((1S,3''R,6''R,7''R,11''S,12''R)-6-chloro-7''-hydroxy-11'',12''-dimethyl-13'',13''-dioxido-15''-oxo-3,4-dihydro-2H-spiro[naphthalene-1,22-[20]oxa[13]thia[1,14]diazatetracyclo[14.7.2.0˜3,6˜.0˜19,24˜]pentacosa[16,18,24]trien]-7''-yl)methyl)octahydro-2H-pyrazino[1,2-a]pyrazin-2-yl)propanoate