solasodine 3-O-β-D-galactoside

solasodine 3-<i>O</i>-β-<i>D</i>-galactoside




Chemical Formula:
C33H53NO7
Molecular Weight:
575.784 Daltons
Monoisotopic Mass:
575.3822030612 Daltons
SMILES:
CC1(CNC2(CC1)(C(C)C3([CH](O2)CC4(C(C)3CC[CH]5([CH]4CC=C7(C(C)5CCC(OC6(OC(CO)C(O)C(O)C(O)6))C7))))))
InChI:
1S/C33H53NO7/c1-17-7-12-33(34-15-17)18(2)26-24(41-33)14-23-21-6-5-19-13-20(8-10-31(19,3)22(21)9-11-32(23,26)4)39-30-29(38)28(37)27(36)25(16-35)40-30/h5,17-18,20-30,34-38H,6-16H2,1-4H3/t17-,18+,20+,21-,22+,23?,24+,25-,26?,27+,28+,29-,30-,31+,32+,33-/m1/s1
InChIKey:
XMLLJGHZPHTUKK-SPNSWKMXSA-N

Synonyms
  • solasodine galactoside

Databases
MetaCyc:  CPD-18738
PubChem (CID):  122706341
MetaNetX:  MNXM681505