COMPOUND: C08837
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Entry
C08837 Compound
Name
Poststerone;
(2beta,3beta,5beta)-2,3,14-Trihydroxypregn-7-ene-6,20-dione
Formula
C21H30O5
Exact mass
362.2093
Mol weight
362.4599
Structure
Mol file
KCF file
DB search
Brite
Lipids [BR:
br08002
]
ST Sterol lipids
ST02 Steroids
ST0203 C21 steroids (gluco/mineralocorticoids, progestogins) and derivatives
C08837 Poststerone
Phytochemical compounds [BR:
br08003
]
Terpenoids
Steroids
Pregnane
C08837 Poststerone
BRITE hierarchy
Other DBs
CAS:
10162-99-9
PubChem:
11030
ChEBI:
27709
LIPIDMAPS:
LMST02030165
KNApSAcK:
C00003669
3DMET:
B02447
NIKKAJI:
J15.595K
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All DBs
KCF data
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ATOM 26
1 C2y C 23.9271 -19.3896
2 C1z C 25.1040 -18.7138
3 C1y C 22.6800 -18.7021
4 C2x C 23.9271 -20.7532
5 C1z C 25.1216 -17.3562
6 C1x C 27.5339 -18.6729
7 O1a O 25.0923 -20.0772
8 C1z C 21.4972 -19.3780
9 C1x C 22.6917 -17.3386
10 C5x C 22.7383 -21.4407
11 C1y C 26.3101 -16.6919
12 C1x C 23.9504 -16.6686
13 C1a C 25.1157 -15.9927
14 C1x C 27.4813 -17.3852
15 C1y C 21.4913 -20.7474
16 C1x C 20.3902 -18.6963
17 C1a C 21.4854 -18.0146
18 O5x O 22.7325 -22.8042
19 C5a C 26.3101 -15.3226
20 C1x C 20.3902 -21.4349
21 C1y C 19.2014 -19.3780
22 C1a C 25.1273 -14.6409
23 O5a O 27.4930 -14.6466
24 C1y C 19.2014 -20.7474
25 O1a O 18.0186 -18.6963
26 O1a O 18.0186 -21.4349
BOND 29
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1
6 2 7 1 #Down
7 3 8 1
8 3 9 1
9 4 10 1
10 5 11 1
11 5 12 1
12 5 13 1 #Up
13 6 14 1
14 8 15 1
15 8 16 1
16 8 17 1 #Up
17 10 18 2
18 11 19 1
19 15 20 1
20 16 21 1
21 19 22 1
22 19 23 2
23 20 24 1
24 21 25 1 #Up
25 24 26 1 #Up
26 9 12 1
27 10 15 1
28 11 14 1
29 21 24 1
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