input word = C00032622

Metabolite InformationStructural formula
Name 25-O-Acetylbryoamaride
Formula C38H56O13
Mw 720.37209188
CAS RN 61014-18-4
C_ID C00032622 ,
InChIKey FZZZUXSEPKGDPU-BREKBCNDNA-N
InChICode InChI=1S/C38H56O13/c1-18(40)51-33(2,3)13-12-25(42)38(9,48)30-21(41)15-35(6)24-11-10-19-20(37(24,8)26(43)16-36(30,35)7)14-22(31(47)34(19,4)5)49-32-29(46)28(45)27(44)23(17-39)50-32/h10,14,20-21,23-24,27-30,32,39,41,44-46,48H,11-13,15-17H2,1-9H3/t20-,21-,23-,24+,27-,28+,29-,30+,32-,35+,36-,37-,38+/m1/s1
SMILES C1(=C[C@@H]2C(=CC[C@@H]3[C@@]2(C(=O)C[C@]2([C@]3(C[C@H]([C@@H]2[C@@](C(=O)CCC(OC(=O)C)(C)C)(C)O)O)C)C)C)C(C1=O)(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeGymnopetalum integrifolium Ref.
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OrganismGymnopetalum integrifolium
ReferenceSekine,Chem.Pharm.Bull.,50,(2005),645