KEGG   COMPOUND: C09804Help
Entry
C09804                      Compound                               

Name
cis-trans-Nepetalactol;
cis-trans-Iridodial lactol;
(+)-cis,trans-Nepetalactol;
(4aS,7S,7aR)-4,7-Dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-ol
Formula
C10H16O2
Exact mass
168.115
Mol weight
168.2328
Structure
Mol fileKCF fileDB search
Comment
Iridodial (tautomer) [CPD:C06069]
(+)-Iridodial (tautomer) [CPD:C09785]
Reaction
Pathway
map00902  Monoterpenoid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Enzyme
1.3.1.99        1.14.14.161
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0102 C10 isoprenoids (monoterpenes)
    PR010207 Iridoid, 10-alkyliridoid and secoiridoid monoterpenoids
     C09804  (+)-Iridodial
Phytochemical compounds [BR:br08003]
 Terpenoids
  Monoterpenoids (C10)
   Iridoids
    C09804  cis-trans-Nepetalactol
BRITE hierarchy
Other DBs
PubChem: 11992
ChEBI: 26
LIPIDMAPS: LMPR0102070017
KNApSAcK: C00003085
3DMET: B03301
NIKKAJI: J20.701B
KCF data Show

ATOM        12
            1   O1a O    21.1607  -16.6702
            2   C1y C    19.9653  -14.5881
            3   C1y C    19.9653  -13.2028
            4   C1y C    21.1641  -15.2869
            5   C1y C    18.6486  -15.0068
            6   C2y C    21.1641  -12.5098
            7   C1x C    18.6486  -12.7770
            8   O2x O    22.3630  -14.5940
            9   C1x C    17.8464  -13.8897
            10  C2x C    22.3630  -13.2028
            11  C1a C    21.1641  -11.1188
            12  C1a C    18.2130  -16.3195
BOND        13
            1     2   3 1
            2     2   4 1
            3     2   5 1
            4     3   6 1
            5     3   7 1
            6     4   8 1
            7     5   9 1
            8     6  10 2
            9     6  11 1
            10    7   9 1
            11    8  10 1
            12    4   1 1 #Up
            13    5  12 1 #Up

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