tryprostatin B
Chemical Formula:
C21H25N3O2
Molecular Weight:
351.447 Daltons
Monoisotopic Mass:
351.1946770623 Daltons
SMILES:
CC(C)=CCC2(=C(C1(=CC=CC=C1N2))C[CH]3(C(N4(CCC[CH](C(N3)=O)4))=O))
InChI:
1S/C21H25N3O2/c1-13(2)9-10-17-15(14-6-3-4-7-16(14)22-17)12-18-21(26)24-11-5-8-19(24)20(25)23-18/h3-4,6-7,9,18-19,22H,5,8,10-12H2,1-2H3,(H,23,25)/t18-,19-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-15263
KEGG:
C20512
PubChem (CID):
9863281
MetaboLights:
MTBLC72760
ChEBI:
72760
MetaNetX:
MNXM145099