input word = C00003627

Metabolite InformationStructural formula
Name Labriformin
Formula C31H39NO10S
Mw 617.2294672
CAS RN 66419-07-6
C_ID C00003627 ,
InChIKey BGKAKFOJZRBENJ-ROUBSAOENA-N
InChICode InChI=1S/C31H39NO10S/c1-14-11-29(32-6-7-43-29)31(37)25(39-14)40-18-9-16-10-20-30(42-20)23(26(16,2)12-19(18)41-31)22(34)24(35)27(3)17(4-5-28(27,30)36)15-8-21(33)38-13-15/h6,8,14,16-20,22-23,25,34,36-37H,4-5,7,9-13H2,1-3H3/t14-,16-,17-,18-,19-,20+,22+,23-,25+,26+,27+,28-,29-,30+,31-/m1/s1
SMILES C[C@@H]1CC2(N=CCS2)[C@]2(O)O[C@@H]3C[C@@]4(C)[C@@H](C[C@@H]5O[C@]56[C@@H]4[C@H](O)C(=O)[C@]4(C)[C@@H](C5=CC(=O)OC5)CC[C@]64O)C[C@H]3O[C@@H]2O1
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAsclepias eriocarpa Ref.
PlantaeApocynaceaeAsclepias labriformis Ref.
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