Catalog Number:
AG00ED9Z
Chemical Name:
MPP A
CAS Number:
6453-67-4
Molecular Formula:
C34H36N4O3
Molecular Weight:
548.6746
MDL Number:
MFCD00057989
IUPAC Name:
methyl 3-[(21R,22R)-16-ethenyl-11-ethyl-4-hydroxy-12,17,21,26-tetramethyl-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,4,6,8(26),9,11,13(25),14,16,18(24),19-undecaen-22-yl]propanoate
InChI:
InChI=1S/C34H36N4O3/c1-8-20-16(3)24-13-26-18(5)22(10-11-31(40)41-7)33(37-26)23-12-30(39)32-19(6)27(38-34(23)32)15-29-21(9-2)17(4)25(36-29)14-28(20)35-24/h8,13-15,18,22,37,39H,1,9-12H2,2-7H3/t18-,22-/m1/s1
InChI Key:
KWOKGUTUPNUAGP-XMSQKQJNSA-N
SMILES:
COC(=O)CC[C@H]1[C@H](C)C2=NC1=C1CC(=O)C3=C(C(=Cc4[nH]c(C=c5[nH]c(=C2)c(C)c5C=C)c(c4CC)C)N=C13)C
