13-dihydrocarminomycin
Chemical Formula:
C26H30NO10
Molecular Weight:
516.524 Daltons
Monoisotopic Mass:
516.1869711892 Daltons
SMILES:
CC5(C(O)C([N+])CC(OC4(C3(C(=C2(C(C1(C(=CC=CC=1C(C2=C(C=3CC(C(O)C)(C4)O)O)=O)O))=O))O)))O5)
InChI:
1S/C26H29NO10/c1-9-21(30)13(27)6-16(36-9)37-15-8-26(35,10(2)28)7-12-18(15)25(34)20-19(23(12)32)22(31)11-4-3-5-14(29)17(11)24(20)33/h3-5,9-10,13,15-16,21,28-30,32,34-35H,6-8,27H2,1-2H3/p+1/t9-,10?,13-,15-,16-,21+,26-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-15736
PubChem (CID):
71728447
Seed:
cpd09183
ChEBI:
31058
MetaNetX:
MNXM6643
KEGG:
C12431