methyl 2-[[5'-[3-(carbamoylamino)prop-1-ynyl]-9-(4-hydroxyphenyl)-2',5-dioxo-2,3-diphenyl-7-(4-pyrimidin-2-ylpiperazine-1-carbonyl)spiro[4-oxa-1-azabicyclo[4.3.0]nonane-8,3'-indole]-1'-carbonyl]amino]-3-methyl-butanoate
Molecular Formula:
C52H51N9O9
InChI: InChI=1/C52H51N9O9/c1-31(2)40(46(64)69-3)57-51(68)60-38-22-17-32(12-10-23-54-49(53)67)30-37(38)52(48(60)66)39(45(63)58-26-28-59(29-27-58)50-55-24-11-25-56-50)42-47(65)70-43(34-15-8-5-9-16-34)41(33-13-6-4-7-14-33)61(42)44(52)35-18-20-36(62)21-19-35/h4-9,11,13-22,24-25,30-31,39-44,62H,23,26-29H2,1-3H3,(H,57,68)(H3,53,54,67)/f/h54,57H,53H2
InChIKey: InChIKey=FJXMZJFCAISDBN-JJDQSKGUCB
SMILES: CC(C)C(C(=O)OC)NC(=O)N1C2=C(C=C(C=C2)C#CCNC(=O)N)C3(C1=O)C(C4C(=O)OC(C(N4C3C5=CC=C(C=C5)O)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)N8CCN(CC8)C9=NC=CC=N9
Names:
methyl 2-[[5'-[3-(carbamoylamino)prop-1-ynyl]-9-(4-hydroxyphenyl)-2',5-dioxo-2,3-diphenyl-7-(4-pyrimidin-2-ylpiperazine-1-carbonyl)spiro[4-oxa-1-azabicyclo[4.3.0]nonane-8,3'-indole]-1'-carbonyl]amino]-3-methyl-butanoate
Registries:
PubChem CID 3575244
PubChem ID 4845940
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