input word = C00000189

Metabolite InformationStructural formula
Name 28-Norcastasterone
Brassinone
Norcastasterone
Formula C27H46O5
Mw 450.33452458
CAS RN 83464-85-1
C_ID C00000189 ,
InChIKey YNZRNENZMVIPBX-IJOPVBLBNA-N
InChICode InChI=1S/C27H46O5/c1-14(2)10-23(30)25(32)15(3)17-6-7-18-16-11-21(28)20-12-22(29)24(31)13-27(20,5)19(16)8-9-26(17,18)4/h14-20,22-25,29-32H,6-13H2,1-5H3/t15-,16-,17+,18-,19-,20+,22-,23+,24+,25+,26-,27+/m0/s1
SMILES [C@@H]1([C@H](C[C@H]2[C@](C1)([C@@H]1[C@H]([C@H]3[C@@](CC1)([C@H](CC3)[C@@H]([C@H]([C@H](O)CC(C)C)O)C)C)CC2=O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus annuus Ref.
PlantaeConvolvulaceaePharbitis purpurea Ref.
PlantaeCruciferaeBrassica campestris Ref.
PlantaeCruciferaeBrassica campestris var. pekinensis L. Ref.
PlantaeEquisetaceaeEquisetum arvense Ref.
PlantaeFabaceaeVicia faba Ref.
PlantaeHamamelidaceaeDistylium racemosum Ref.
PlantaePoaceaeZea mays Ref.
PlantaeTheaceaeThea sinensis Ref.
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