input word =
C00028667
Metabolite Information
Structural formula
Name
Neogermbudine
Formula
C37H59NO12
Mw
709.40372636
CAS RN
595-64-2
C_ID
C00028667 ,
InChIKey
LWSPRPDSPCBAKK-UHFFFAOYNA-N
InChICode
InChI=1S/C37H59NO12/c1-8-18(3)30(42)49-29-27(41)26-20(16-38-15-17(2)9-10-24(38)34(26,7)45)21-14-35-28(36(21,29)46)22(40)13-23-32(35,5)12-11-25(37(23,47)50-35)48-31(43)33(6,44)19(4)39/h17-29,39-41,44-47H,8-16H2,1-7H3/t17-,18-,19+,20-,21+,22+,23+,24-,25-,26+,27-,28-,29+,32+,33-,34-,35-,36+,37+/m1/s1
SMILES
[C@H]1(CC[C@H]2N(C1)C[C@H]1[C@H]([C@]2(C)O)[C@H]([C@@H]([C@@]2([C@H]1C[C@@]13[C@H]2[C@H](C[C@H]2[C@@]1(CC[C@H]([C@@]2(O)O3)OC(=O)[C@@]([C@@H](O)C)(O)C)C)O)O)OC(=O)[C@H](C)CC)O)C
Start Substs in Alk. Biosynthesis (Prediction)
L-Arg
Cholesterol
Organism
Kingdom
Family
Species
Reference
Plantae
Melanthiaceae
Veratrum album
Ref.
Plantae
Melanthiaceae
Veratrum nigrum
Ref.
Plantae
Melanthiaceae
Veratrum nigrum var.ussuriense
Ref.
Plantae
Melanthiaceae
Veratrum viride Ait.
Ref.
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