KEGG   COMPOUND: C15054
Entry
C15054                      Compound                               
Name
2,2-Dimethyl-3-(4-methoxyphenyl)-4-ethyl-2H-1-benzopyran-7-ol
Formula
C20H22O3
Exact mass
310.1569
Mol weight
310.3869
Structure
Other DBs
PubChem: 17396051
ChEBI: 79574
NIKKAJI: J2.791.775E
LinkDB
KCF data

ATOM        23
            1   C8y C    21.0416  -14.5426
            2   C8y C    21.0416  -15.9406
            3   C2y C    22.2522  -16.6397
            4   C2y C    23.4632  -15.9406
            5   C1z C    23.4632  -14.5426
            6   O2x O    22.2522  -13.8435
            7   C8x C    19.8309  -13.8435
            8   C8y C    18.6199  -14.5426
            9   C8x C    18.6199  -15.9406
            10  C8x C    19.8309  -16.6397
            11  O1a O    17.4172  -13.8484
            12  C1b C    22.2521  -18.0600
            13  C1a C    21.0455  -18.7564
            14  C8y C    24.6740  -16.6396
            15  C8x C    24.6744  -18.0596
            16  C8x C    25.8871  -18.7592
            17  C8y C    27.0993  -18.0588
            18  C8x C    27.0988  -16.6388
            19  C8x C    25.8862  -15.9392
            20  O2a O    28.3055  -18.7547
            21  C1a C    29.4962  -18.0666
            22  C1a C    24.1632  -13.3302
            23  C1a C    24.8155  -14.9050
BOND        25
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     1   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    2  10 1
            12    8  11 1
            13    3  12 1
            14   12  13 1
            15    4  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 2
            21   14  19 1
            22   17  20 1
            23   20  21 1
            24    5  22 1
            25    5  23 1

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