input word = C00046564

Metabolite InformationStructural formula
Name 17beta,20beta-Epoxy-23,24-dimethylcholest-5-ene-3beta,22-diol
(-)-17beta,20beta-Epoxy-23,24-dimethylcholest-5-ene-3beta,22-diol
Formula C29H48O3
Mw 444.3603454
CAS RN 253195-59-4
C_ID C00046564 ,
InChIKey CIBBJGAKYYGAAG-XMZNDZCPNA-N
InChICode InChI=1S/C29H48O3/c1-17(2)18(3)19(4)25(31)28(7)29(32-28)15-12-24-22-9-8-20-16-21(30)10-13-26(20,5)23(22)11-14-27(24,29)6/h8,17-19,21-25,30-31H,9-16H2,1-7H3/t18-,19+,21+,22-,23+,24+,25-,26+,27+,28+,29+/m1/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)CC[C@]1([C@H]3CC[C@@]21O[C@@]2(C)[C@H](O)[C@H]([C@H](C)C(C)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrchidaceaeSarcophyton crassocaule Ref.
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