input word = C00048528

Metabolite InformationStructural formula
Name Rubrosterone
Formula C19H26O5
Mw 334.17802394
CAS RN 19466-41-2
C_ID C00048528 ,
InChIKey OMQCWEJQYPUGJG-GOHCRIIANA-N
InChICode InChI=1S/C19H26O5/c1-17-9-15(22)14(21)8-12(17)13(20)7-11-10(17)3-5-18(2)16(23)4-6-19(11,18)24/h7,10,12,14-15,21-22,24H,3-6,8-9H2,1-2H3/t10-,12-,14+,15-,17+,18+,19+/m0/s1
SMILES C1[C@H]2C(=CC(=O)[C@H]3[C@@]2(C[C@@H]([C@@H](C3)O)O)C)[C@]2([C@](C1)(C(=O)CC2)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAmaranthaceaeAchyranthes bidentata Ref.
PlantaeAmaranthaceaeAchyranthes rubrofusca Ref.
PlantaeAsteraceaeRhaponticum carthamoides Ref.
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OrganismAchyranthes rubrofusca
ReferenceHikino,Tetrahedron,32,(1976),3015