input word = C00033736

Metabolite InformationStructural formula
Name Cucurbitaglycoside B
(-)-Deribosylcucurbitaglycoside A
Formula C41H57N5O12
Mw 811.40037232
CAS RN 1023952-23-9
C_ID C00033736 ,
InChIKey MREUELDSJSOJLT-IHMBJVBGNA-N
InChICode InChI=1S/C41H57N5O12/c1-36(2)18-9-10-23-38(5)13-20(48)31(41(8,56)25(49)12-24(37(3,4)55)46-34-27-33(43-16-42-27)44-17-45-34)39(38,6)14-26(50)40(23,7)19(18)11-21(32(36)54)57-35-30(53)29(52)28(51)22(15-47)58-35/h9,11,16-17,19-20,22-24,28-31,35,47-48,51-53,55-56H,10,12-15H2,1-8H3,(H2,42,43,44,45,46)/t19-,20-,22-,23+,24-,28+,29+,30-,31+,35-,38+,39-,40+,41+/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)(C(=O)C[C@@H](Nc2ncnc3c2[nH]cn3)C(C)(O)C)O)O)C)C)C)C(C1=O)(C)C)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-His
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeCucurbita pepo cv dayangua Ref.
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OrganismCucurbita pepo cv dayangua
ReferenceWang,Phytochem.,69,(2008),1434