13-deoxycarminomycin
Chemical Formula:
C26H30NO9
Molecular Weight:
500.524 Daltons
Monoisotopic Mass:
500.19205656710005 Daltons
SMILES:
CCC4(CC(C3(C(=C2(C(C1(C(=CC=CC=1C(C2=C(C=3C4)O)=O)O))=O))O))OC5(OC(C)C(O)C([N+])C5))O
InChI:
1S/C26H29NO9/c1-3-26(34)8-12-18(15(9-26)36-16-7-13(27)21(29)10(2)35-16)25(33)20-19(23(12)31)22(30)11-5-4-6-14(28)17(11)24(20)32/h4-6,10,13,15-16,21,28-29,31,33-34H,3,7-9,27H2,1-2H3/p+1/t10-,13-,15-,16-,21+,26-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-15732
ChEBI:
140329
PubChem (CID):
90658253
Seed:
cpd09180
MetaNetX:
MNXM5424
KEGG:
C12428