input word = C00044803

Metabolite InformationStructural formula
Name Hippuristerone E
(-)-Hippuristerone E
Formula C33H52O7
Mw 560.37130401
CAS RN 549528-38-3
C_ID C00044803 ,
InChIKey SHCXXWJWIBXMRR-GHGGMLRINA-N
InChICode InChI=1S/C33H52O7/c1-18(19(2)30(5,6)40-21(4)35)29(39-20(3)34)33(9,38)28-27(37)17-26-24-11-10-22-16-23(36)12-14-31(22,7)25(24)13-15-32(26,28)8/h18-19,22,24-26,28-29,38H,10-17H2,1-9H3/t18-,19-,22-,24+,25-,26-,28-,29+,31-,32-,33+/m0/s1
SMILES C1C(=O)C[C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@H]2[C@](CC1)([C@H](C(=O)C2)[C@@]([C@@H]([C@H]([C@@H](C(C)(C)OC(=O)C)C)C)OC(=O)C)(C)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Isis hippuris Ref.
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OrganismIsis hippuris
ReferenceSheu,J.Nat.Prod.,66,(2003),917