input word = C00042581

Metabolite InformationStructural formula
Name Hippuristerol E
(+)-Hippuristerol E
Formula C31H52O5
Mw 504.38147477
CAS RN 868395-88-4
C_ID C00042581 ,
InChIKey MCEICBGPGATZRB-YTHHYTMTNA-N
InChICode InChI=1S/C31H52O5/c1-18(19(2)27(4,5)34)26(35-20(3)32)30(8)31(36-30)16-13-25-23-10-9-21-17-22(33)11-14-28(21,6)24(23)12-15-29(25,31)7/h18-19,21-26,33-34H,9-17H2,1-8H3/t18-,19-,21-,22+,23+,24-,25-,26+,28-,29-,30-,31-/m0/s1
SMILES CC(=O)O[C@H]([C@@H](C)[C@H](C)C(C)(C)O)[C@]1(C)O[C@]12CC[C@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Isis hippuris Ref.
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