input word = C00048459

Metabolite InformationStructural formula
Name Kuguacin J
Formula C30H46O3
Mw 454.34469533
CAS RN 1141453-65-7
C_ID C00048459 ,
InChIKey JWZXELQQTJCVII-SVLGZMACNA-N
InChICode InChI=1S/C30H46O3/c1-19(2)9-8-10-20(3)21-13-14-29(7)26-24(32)17-23-22(11-12-25(33)27(23,4)5)30(26,18-31)16-15-28(21,29)6/h8-9,17-18,20-22,24-26,32-33H,1,10-16H2,2-7H3/b9-8+/t20-,21-,22-,24-,25+,26+,28-,29+,30-/m1/s1
SMILES C1[C@@]2([C@H]([C@]3([C@](C1)([C@H](CC3)[C@@H](C/C=C/C(=C)C)C)C)C)[C@@H](C=C1[C@H]2CC[C@@H](C1(C)C)O)O)C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica charantia Ref.
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