| Entry |
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| Name |
|
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| Formula |
C22H22O8
|
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| Exact mass |
414.1315
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| Mol weight |
414.4053
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| Structure |
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| Remark |
|
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| Reaction |
R12127
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| Pathway |
| map00999 | Biosynthesis of various plant secondary metabolites |
| map01061 | Biosynthesis of phenylpropanoids |
| map01100 | Metabolic pathways |
| map01110 | Biosynthesis of secondary metabolites |
|
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| Module |
| M00902 | Podophyllotoxin biosynthesis, coniferyl alcohol => podophyllotoxin |
|
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| Brite |
Phytochemical compounds [BR:br08003]
Phenylpropanoids
Lignans
Lignans
C10874 Podophyllotoxin
Natural toxins [BR:br08009]
Phytotoxins
Others
Others
C10874 Podophyllotoxin
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C10874
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
D DERMATOLOGICALS
D06 ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
D06B CHEMOTHERAPEUTICS FOR TOPICAL USE
D06BB Antivirals
D06BB04 Podophyllotoxin
D05529 Podofilox (USAN) <US>
USP drug classification [BR:br08302]
Dermatological Agents
Dermatological Agents, Other
Warts and Actinic Keratosis Agents
Podofilox
D05529 Podofilox (USAN)
Antimicrobials [BR:br08307]
Antivirals
Others
Natural product
D05529 Podofilox (USAN) <US>
Antimicrobials abbreviations [BR:br08327]
Antivirals
Others
Natural product
D05529 Podofilox (USAN)
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| Other DBs |
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| KCF data |
ATOM 30
1 C8x C 21.8565 -23.3707
2 C8y C 21.8565 -24.7739
3 C8y C 23.0758 -25.4791
4 C8y C 24.2877 -24.7739
5 C8x C 24.2877 -23.3707
6 C8y C 23.0758 -22.6726
7 C8x C 20.6603 -21.2641
8 C8x C 20.6603 -18.4574
9 C8y C 21.8724 -19.1557
10 C8y C 21.8665 -20.5589
11 C1y C 23.0797 -21.2692
12 C1y C 23.0917 -18.4626
13 C1y C 24.3048 -19.1660
14 C1y C 24.2923 -20.5683
15 C7x C 25.6158 -21.0185
16 O7x O 26.4598 -19.8897
17 C1x C 25.6429 -18.7393
18 C8y C 19.4482 -20.5589
19 C8y C 19.4548 -19.1601
20 O2x O 18.1259 -18.7168
21 C1x C 17.2959 -19.8529
22 O2x O 18.1156 -20.9828
23 O2a O 25.5046 -25.4783
24 O2a O 23.0775 -26.8825
25 O2a O 20.6405 -25.4798
26 C1a C 26.7203 -24.7722
27 C1a C 19.4311 -24.7753
28 C1a C 24.2945 -27.5791
29 O6a O 26.4798 -21.9903
30 O1a O 23.0678 -16.7480
BOND 34
1 14 15 1
2 15 16 1
3 16 17 1
4 17 13 1
5 9 8 1
6 8 19 2
7 2 3 1
8 3 4 2
9 4 5 1
10 18 19 1
11 19 20 1
12 20 21 1
13 21 22 1
14 22 18 1
15 11 6 1 #Down
16 5 6 2
17 9 10 2
18 4 23 1
19 10 11 1
20 3 24 1
21 11 14 1
22 2 25 1
23 13 12 1
24 23 26 1
25 12 9 1
26 25 27 1
27 6 1 1
28 24 28 1
29 15 29 2
30 1 2 2
31 18 7 2
32 7 10 1
33 13 14 1
34 12 30 1 #Down
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