input word = C00045038

Metabolite InformationStructural formula
Name Reissantin A
Formula C33H39NO11
Mw 625.2523111
CAS RN 628290-35-7
C_ID C00045038 ,
InChIKey PEFXNCJFEYSZKT-UHFFFAOYNA-N
InChICode InChI=1S/C33H39NO11/c1-18(35)41-22-15-16-31(5,40)33-26(43-29(39)21-13-14-23(37)34(7)17-21)24(30(3,4)45-33)25(42-19(2)36)27(32(22,33)6)44-28(38)20-11-9-8-10-12-20/h8-14,17,22,24-27,40H,15-16H2,1-7H3/t22-,24-,25-,26-,27+,31-,32-,33+/m0/s1
SMILES c1(=O)n(cc(cc1)C(=O)O[C@H]1[C@@H]2[C@@H]([C@H]([C@]3([C@@]1([C@](CC[C@@H]3OC(=O)C)(O)C)OC2(C)C)C)OC(=O)c1ccccc1)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction) GGPP L-Asp L-His
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeReissantia buchananii Ref.
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