KEGG   COMPOUND: C09737
Entry
C09737                      Compound                               

Name
Solavetivone
Formula
C15H22O
Exact mass
218.1671
Mol weight
218.3346
Structure
Reaction
Pathway
map00909  Sesquiterpenoid and triterpenoid biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0103 C15 isoprenoids (sesquiterpenes)
    PR010365 Spirovetivane sesquiterpenoids
     C09737  Solavetivone
Phytochemical compounds [BR:br08003]
 Terpenoids
  Sesquiterpenoids (C15)
   Bisabolanes
    C09737  Solavetivone
Other DBs
CAS: 54878-25-0
PubChem: 11925
ChEBI: 9192
ChEMBL: CHEMBL465907
KNApSAcK: C00003191
3DMET: B03236
KCF data

ATOM        16
            1   C1z C    26.8821  -16.1382
            2   C1x C    27.2382  -17.4871
            3   C1x C    28.0441  -15.3792
            4   C1y C    25.6734  -16.8389
            5   C2y C    26.8821  -14.7310
            6   C1y C    28.6338  -17.4872
            7   C1x C    29.1302  -16.2550
            8   C1x C    24.4530  -16.1324
            9   C1a C    25.6734  -18.2403
            10  C2x C    25.6734  -14.0303
            11  C1a C    28.0966  -14.0363
            12  C2c C    29.3930  -18.7366
            13  C5x C    24.4530  -14.7310
            14  C2a C    30.7942  -18.7365
            15  C1a C    28.7564  -19.9863
            16  O5x O    23.2385  -14.0303
BOND        17
            1     1   2 1 #Up
            2     1   3 1 #Down
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     4   9 1 #Down
            9     5  10 2
            10    5  11 1
            11    6  12 1 #Up
            12    8  13 1
            13   12  14 2
            14   12  15 1
            15   13  16 2
            16    6   7 1
            17   10  13 1

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