input word = C00035843

Metabolite InformationStructural formula
Name Isocucurbitacin R
Formula C30H46O7
Mw 518.32435382
CAS RN 3877-89-2
C_ID C00035843 ,
InChIKey YQLCUPUXBKOMCZ-FIJCNJGSNA-N
InChICode InChI=1S/C30H46O7/c1-25(2,36)12-11-21(33)30(8,37)23-19(32)14-27(5)20-10-9-16-17(13-18(31)24(35)26(16,3)4)29(20,7)22(34)15-28(23,27)6/h9,17,19-20,23-24,32,35-37H,10-15H2,1-8H3/t17-,19-,20+,23+,24-,27+,28-,29+,30+/m1/s1
SMILES C1(=O)[C@H](C(C2=CC[C@@H]3[C@]([C@@H]2C1)(C(=O)C[C@]1([C@]3(C[C@H]([C@@H]1[C@](C)(C(=O)CCC(C)(C)O)O)O)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeCucumis melo Ref.
PlantaeCucurbitaceaeDendrosicyos socotrana Ref.
--dendrosicyos socotrana Ref.
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