L-oleandrosyl-oleandolide
Chemical Formula:
C27H46O10
Molecular Weight:
530.654 Daltons
Monoisotopic Mass:
530.3090976976 Daltons
SMILES:
CC3(CC1(CO1)C(=O)C(C)C(O)C(C)C(C)OC(=O)C(C)C(OC2(CC(OC)C(O)C(C)O2))C(C)C(O)3)
InChI:
1S/C27H46O10/c1-12-10-27(11-34-27)25(31)15(4)22(29)13(2)17(6)36-26(32)16(5)24(14(3)21(12)28)37-20-9-19(33-8)23(30)18(7)35-20/h12-24,28-30H,9-11H2,1-8H3/t12-,13-,14+,15+,16+,17+,18-,19-,20-,21-,22-,23-,24-,27+/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-13825
KEGG:
C11992
PubChem (CID):
443566
MetaboLights:
MTBLC29613
ChEBI:
29613
Seed:
cpd08789
MetaNetX:
MNXM3636