input word = C00000197

Metabolite InformationStructural formula
Name 2-Deoxy-25-Methyldolichosterone
Formula C29H48O4
Mw 460.35526002
CAS RN 121044-89-1
C_ID C00000197 ,
InChIKey VWEHHIHNZFXYIU-PADMIEJDNA-N
InChICode InChI=1S/C29H48O4/c1-16(25(32)26(33)17(2)27(3,4)5)20-8-9-21-19-15-24(31)23-14-18(30)10-12-29(23,7)22(19)11-13-28(20,21)6/h16,18-23,25-26,30,32-33H,2,8-15H2,1,3-7H3/t16-,18+,19-,20+,21-,22-,23+,25+,26+,28-,29+/m0/s1
SMILES C1[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)C(=C)C(C)(C)C)O)C)C)CC2=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePhaseolus vulgaris Ref.
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