holyrine A
Chemical Formula:
C26H25N4O3
Molecular Weight:
441.508 Daltons
Monoisotopic Mass:
441.1926656896 Daltons
SMILES:
CC1(OC(CC([N+])C(O)1)N7(C2(C=CC=CC=2C6(C3(C(=O)NCC=3C5(C4(C=CC=CC=4NC=5C=67)))))))
InChI:
1S/C26H24N4O3/c1-12-25(31)16(27)10-19(33-12)30-18-9-5-3-7-14(18)21-22-15(11-28-26(22)32)20-13-6-2-4-8-17(13)29-23(20)24(21)30/h2-9,12,16,19,25,29,31H,10-11,27H2,1H3,(H,28,32)/p+1/t12-,16+,19+,25-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-11906
PubChem (CID):
45479544
Seed:
cpd23138
MetaNetX:
MNXM11826
KEGG:
C21127