input word = C00032200

Metabolite InformationStructural formula
Name Stellatogenin
Formula C30H48O4
Mw 472.35526002
CAS RN 13950-49-7
C_ID C00032200 ,
InChIKey KBZAUMGEQVDBJE-DYKCPFABNA-N
InChICode InChI=1S/C30H48O4/c1-25(2)19-10-13-29(7)20(27(19,5)12-11-21(25)31)9-8-17-22-23(26(3,4)33)18-16-30(22,24(32)34-18)15-14-28(17,29)6/h17-23,31,33H,8-16H2,1-7H3/t17-,18+,19-,20-,21+,22-,23-,27+,28-,29-,30-/m1/s1
SMILES C1[C@@H](C([C@@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2([C@H](CC1)[C@H]1[C@]3(CC2)C(=O)O[C@H]([C@H]1C(O)(C)C)C3)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCactaceaeStenocereus eruca Ref.
--Lemaireocereus stellatus Ref.
--Machaerocereus eruca Ref.
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OrganismMachaerocereus eruca
ReferenceYe,J.Nat.Prod.,61,(1998),456