1812866-39-9 (2-aminobenzoylacetyl-CoA,2-aminobenzoylacetyl-CoA)

CAS号:
1812866-39-9
中文名称:
2-aminobenzoylacetyl-CoA
英文名称:
2-aminobenzoylacetyl-CoA
分子式:
C30H43N8O18P3S
分子量:
928.69150853157

2-aminobenzoylacetyl-CoA(1812866-39-9)名称与标识符

标识符

InChIKey:
OLOTULRNHWZRKJ-FUEUKBNZSA-N
Inchi:
1S/C30H43N8O18P3S/c1-30(2,25(43)28(44)34-8-7-20(40)33-9-10-60-21(41)11-18(39)16-5-3-4-6-17(16)31)13-53-59(50,51)56-58(48,49)52-12-19-24(55-57(45,46)47)23(42)29(54-19)38-15-37-22-26(32)35-14-36-27(22)38/h3-6,14-15,19,23-25,29,42-43H,7-13,31H2,1-2H3,(H,33,40)(H,34,44)(H,48,49)(H,50,51)(H2,32,35,36)(H2,45,46,47)/t19-,23-,24-,25+,29-/m1/s1
SMILES:
CC([C@H](C(NCCC(NCCSC(CC(C1C=CC=CC=1N)=O)=O)=O)=O)O)(COP(OP(OC[C@@H]1[C@@H](OP(=O)(O)O)[C@@H](O)[C@H](N2C3C(=C(N=CN=3)N)N=C2)O1)(=O)O)(=O)O)C