20-deoxo-20-dihydro-12,13-deepoxyrosamicin
Chemical Formula:
C31H54NO7
Molecular Weight:
552.77 Daltons
Monoisotopic Mass:
552.3900280933 Daltons
SMILES:
CCC2(C(OC1(OC(C)CC([N+](C)C)C(O)1))C(C)C(O)CC(OC(CC)C(C)C=C(C=CC(C(C)C2)=O)C)=O)
InChI:
1S/C31H53NO7/c1-10-23-15-19(4)25(33)13-12-18(3)14-20(5)27(11-2)38-28(35)17-26(34)22(7)30(23)39-31-29(36)24(32(8)9)16-21(6)37-31/h12-14,19-24,26-27,29-31,34,36H,10-11,15-17H2,1-9H3/p+1/b13-12+,18-14+/t19-,20+,21-,22+,23+,24+,26-,27-,29-,30-,31-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-18072
PubChem (CID):
91820304
MetaNetX:
MNXM147746