5-N-acetylardeemin
Chemical Formula:
C28H28N4O3
Molecular Weight:
468.554 Daltons
Monoisotopic Mass:
468.2161407859 Daltons
SMILES:
C=CC(C)(C)C35(C6(C(N(C(C)=O)C(N2(C(=O)C(N1(C(=O)C4(C(N=C1C2C3)=CC=CC=4)))C))5)=CC=CC=6))
InChI:
1S/C28H28N4O3/c1-6-27(4,5)28-15-22-23-29-20-13-9-7-11-18(20)25(35)30(23)16(2)24(34)32(22)26(28)31(17(3)33)21-14-10-8-12-19(21)28/h6-14,16,22,26H,1,15H2,2-5H3/t16-,22+,26?,28-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-16986
PubChem (CID):
90658426
ChemSpider:
112978
MetaNetX:
MNXM148674