| Entry |
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| Name |
Estradiol benzoate;
17-beta-Estradiol 3-benzoate
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| Formula |
C25H28O3
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| Exact mass |
376.2038
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| Mol weight |
376.488
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| Structure |
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| Remark |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
G GENITO URINARY SYSTEM AND SEX HORMONES
G03 SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
G03C ESTROGENS
G03CA Natural and semisynthetic estrogens, plain
G03CA03 Estradiol
D01953 Estradiol benzoate (JP18/USP)
Classification of Japanese OTC drugs [BR:br08313]
Agents for integumentary system
60 Hair remedies (incl. hair growth, hair tonic, anti-dandruff, and antipruritic)
D01953 Estradiol benzoate (JP18/USP)
Risk category of Japanese OTC drugs [BR:br08312]
Designated second-class OTC drugs
Inorganic and organic chemicals
Estradiol benzoate
D01953 Estradiol benzoate (JP18/USP)
Second-class OTC drugs
Inorganic and organic chemicals
Estradiol benzoate
D01953 Estradiol benzoate (JP18/USP)
Animal drugs in Japan [BR:br08331]
94 Agents for breeding
941 Hormone preparations (except posterior-pituitary hormone and preparations)
9414 Follicle stimulating hormone and preparations
C13444 Estradiol benzoate
Drug groups [BR:br08330]
Hormonal agent
DG01986 Estrogen
DG00462 Estradiol
D01953 Estradiol benzoate
DG01584 Estrogen receptor agonist
DG00462 Estradiol
D01953 Estradiol benzoate
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00462 Estradiol
D01953 Estradiol benzoate
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
Estrogen receptor
NR3A (ESR)
D01953 Estradiol benzoate (JP18/USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
Chemicals
D01953 Estradiol benzoate
D01953 Estradiol benzoate injection (aqueous suspension)
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D01953
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 28
1 C1x C 24.1622 -14.9985
2 C1y C 24.1622 -16.3696
3 C1y C 25.3496 -17.0552
4 C1y C 26.5371 -16.3696
5 C1z C 26.5371 -14.9985
6 C1x C 25.3496 -14.3129
7 C8y C 22.9748 -17.0552
8 C8y C 22.9748 -18.4263
9 C1x C 24.1622 -19.1118
10 C1x C 25.3496 -18.4263
11 C8x C 21.7873 -16.3696
12 C8x C 20.5999 -17.0552
13 C8y C 20.5999 -18.4263
14 C8x C 21.7873 -19.1118
15 C1x C 28.9119 -16.3696
16 C1x C 28.9119 -14.9985
17 C1y C 27.7245 -14.3129
18 O7a O 19.4099 -19.1118
19 C7a C 18.2224 -18.4263
20 C8y C 17.0350 -19.1118
21 O6a O 18.2224 -17.0552
22 C8x C 15.8455 -18.4252
23 C8x C 14.6581 -19.1108
24 C8x C 14.6581 -20.4819
25 C8x C 15.8476 -21.1685
26 C8x C 17.0350 -20.4830
27 O1a O 27.7272 -12.9418
28 C1a C 26.5389 -13.6273
BOND 32
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 2 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 3 10 1
12 7 11 2
13 11 12 1
14 12 13 2
15 13 14 1
16 8 14 2
17 4 15 1
18 15 16 1
19 16 17 1
20 5 17 1
21 13 18 1
22 18 19 1
23 19 20 1
24 19 21 2
25 20 22 2
26 22 23 1
27 23 24 2
28 24 25 1
29 25 26 2
30 20 26 1
31 17 27 1 #Up
32 5 28 1 #Up
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