KEGG   COMPOUND: C09073Help
Entry
C09073                      Compound                               

Name
Chasmanthin
Formula
C20H22O7
Exact mass
374.1366
Mol weight
374.3845
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Terpenoids
  Diterpenoids (C20)
   Clerodanes
    C09073  Chasmanthin
BRITE hierarchy
Other DBs
CAS: 20379-19-5
PubChem: 11265
ChEBI: 3581
ChEMBL: CHEMBL458613
KNApSAcK: C00003413
3DMET: B02661
NIKKAJI: J16.609J
KCF data Show

ATOM        27
            1   C1z C    24.8667  -18.2273
            2   C1y C    24.8726  -16.8630
            3   C1z C    23.6888  -18.9147
            4   C1x C    26.0435  -18.9207
            5   C1a C    24.9255  -19.3863
            6   C1y C    23.6888  -16.1802
            7   C1z C    26.0551  -16.1859
            8   C1y C    22.5108  -18.2273
            9   C7x C    23.1351  -20.0926
            10  O1a O    24.2877  -20.2335
            11  C1x C    27.2332  -18.2390
            12  C1y C    22.5108  -16.8630
            13  O7x O    23.1857  -17.4274
            14  C1y C    27.2332  -16.8804
            15  C1x C    26.0668  -14.8275
            16  C1a C    25.4835  -17.6845
            17  O2x O    21.3212  -17.5562
            18  O6a O    22.1003  -20.7134
            19  C7x C    28.4112  -16.2092
            20  C1y C    27.2565  -14.1517
            21  O7x O    28.4228  -14.8450
            22  O6a O    29.5947  -16.8980
            23  C8y C    27.2703  -12.7509
            24  C8x C    28.4095  -11.9290
            25  O2x O    27.9919  -10.5922
            26  C8x C    26.5912  -10.5785
            27  C8x C    26.1474  -11.9067
BOND        32
            1     2   6 1
            2     2   7 1
            3     3   8 1
            4     3   9 1 #Up
            5     3  10 1 #Down
            6     4  11 1
            7     6  12 1
            8     6  13 1 #Up
            9     7  14 1
            10    7  15 1
            11    7  16 1 #Up
            12    8  17 1
            13    9  18 2
            14   14  19 1
            15   15  20 1
            16   19  21 1
            17   19  22 2
            18    8  12 1
            19    9  13 1
            20   11  14 1
            21   12  17 1
            22   20  21 1
            23   20  23 1 #Down
            24    1   2 1
            25    1   3 1
            26    1   4 1
            27    1   5 1 #Down
            28   23  24 2
            29   24  25 1
            30   25  26 1
            31   26  27 2
            32   27  23 1

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