input word =
C00026039
Metabolite Information
Structural formula
Name
Staphisine
Formula
C43H60N2O2
Mw
636.46547917
CAS RN
36576-56-4
C_ID
C00026039 ,
InChIKey
VQVYYLMLZPYPBR-UHFFFAOYNA-N
InChICode
InChI=1S/C43H60N2O2/c1-37-9-6-10-43-31(37)8-12-40-21-41(29(17-32(40)43)34(46-5)33(40)35(43)45(4)23-37)13-14-42-28-16-27-25-15-24-18-38(2,22-44(3)20-24)26(25)7-11-39(27,19-30(28)42)36(42)47-41/h16,24,28-36H,6-15,17-23H2,1-5H3/t24-,28+,29+,30-,31+,32+,33+,34-,35+,36+,37-,38+,39+,40-,41+,42+,43-/m1/s1
SMILES
[C@H]12[C@H]([C@@H]3[C@@]4([C@H](C2)[C@@]25CCC[C@](CN([C@@H]35)C)([C@@H]2CC4)C)C[C@]21CC[C@@]13[C@H]4C=C5C6=C([C@@]7(CN(C[C@H](C6)C7)C)C)CC[C@]5([C@@H]1O2)C[C@@H]34)OC
Start Substs in Alk. Biosynthesis (Prediction)
L-Pro
L-Arg
Cholesterol
Organism
Kingdom
Family
Species
Reference
Plantae
Ranunculaceae
Delphinium ajacis
Ref.
Plantae
Ranunculaceae
Delphinium elatum
Ref.
Plantae
Ranunculaceae
Delphinium staphisagra
Ref.
Plantae
Ranunculaceae
Delphinium staphisagria
Ref.
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