COMPOUND: C14475
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Entry
C14475 Compound
Name
Bolasterone;
7alpha,17alpha-Dimethyltestosterone;
17beta-Hydroxy-7alpha,17-dimethylandrost-4-en-3-one;
U19763
Formula
C21H32O2
Exact mass
316.2402
Mol weight
316.4776
Structure
Mol file
KCF file
DB search
Remark
Same as:
D03144
Brite
Lipids [BR:
br08002
]
ST Sterol lipids
ST02 Steroids
ST0202 C19 steroids (androgens) and derivatives
C14475 Bolasterone
Drug groups [BR:
br08330
]
Hormonal agent
DG01590 Androgen receptor agonist
DG01605 Anabolic steroid
D03144 Bolasterone
Target-based classification of drugs [BR:
br08310
]
Nuclear receptors
Estrogen like receptors
3-Ketosteroid receptor
NR3C4 (AR)
D03144 Bolasterone (USAN/INN)
BRITE hierarchy
Other DBs
CAS:
1605-89-6
PubChem:
17395475
ChEBI:
34583
LIPIDMAPS:
LMST02020017
NIKKAJI:
J7.528K
LinkDB
All DBs
KCF data
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ATOM 23
1 C1x C 25.3131 -17.9359
2 C5x C 25.3131 -19.2973
3 C2x C 26.4921 -19.9779
4 C2y C 27.6710 -19.2973
5 C1z C 27.6710 -17.9359
6 C1x C 26.4921 -17.2553
7 C1x C 28.8499 -19.9779
8 C1y C 30.0288 -19.2973
9 C1y C 30.0288 -17.9359
10 C1y C 28.8499 -17.2553
11 C1y C 31.2079 -17.2553
12 C1z C 31.2079 -15.8940
13 C1x C 30.0288 -15.2134
14 C1x C 28.8499 -15.8940
15 C1x C 33.5656 -17.2553
16 C1x C 33.5656 -15.8940
17 C1z C 32.3867 -15.2134
18 C1a C 31.2349 -14.5328
19 O1a O 32.3919 -13.8521
20 C1a C 31.2450 -19.9995
21 O5x O 24.0926 -20.0023
22 C1a C 27.6680 -16.5354
23 C1a C 33.6932 -14.8540
BOND 26
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 12 18 1 #Up
22 17 19 1 #Up
23 8 20 1 #Down
24 2 21 2
25 5 22 1 #Up
26 17 23 1 #Down
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