tryptoquialanine
Chemical Formula:
C27H26N4O7
Molecular Weight:
518.525 Daltons
Monoisotopic Mass:
518.1801492101 Daltons
SMILES:
CC(OC(=O)C)C5(N(C1(CC3(OC(=O)1)(C4(=C(N2(C(=O)C(C)(C)N(O)C23))C=CC=C4))))C(=O)C6(C=CC=CC(N=5)=6))
InChI:
1S/C27H26N4O7/c1-14(37-15(2)32)21-28-18-11-7-5-9-16(18)22(33)29(21)20-13-27(38-23(20)34)17-10-6-8-12-19(17)30-24(27)31(36)26(3,4)25(30)35/h5-12,14,20,24,36H,13H2,1-4H3/t14-,20+,24-,27-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-17869
PubChem (CID):
11060368
MetaNetX:
MNXM149208