rosamicin
Chemical Formula:
C31H52NO9
Molecular Weight:
582.753 Daltons
Monoisotopic Mass:
582.3642072733 Daltons
SMILES:
CCC2(C(C)C3(OC(C=CC(C(C)CC(CC=O)C(OC1(OC(C)CC([N+](C)C)C(O)1))C(C)C(O)CC(O2)=O)=O)(C)3))
InChI:
1S/C31H51NO9/c1-9-25-20(5)29-31(6,41-29)12-10-23(34)17(2)14-21(11-13-33)28(19(4)24(35)16-26(36)39-25)40-30-27(37)22(32(7)8)15-18(3)38-30/h10,12-13,17-22,24-25,27-30,35,37H,9,11,14-16H2,1-8H3/p+1/b12-10+/t17-,18-,19+,20-,21+,22+,24-,25-,27-,28-,29?,30-,31?/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-18070
PubChem (CID):
91820173
ChemSpider:
5020508
MetaNetX:
MNXM81106