COMPOUND: C20475
Help
Entry
C20475 Compound
Name
Sporulenol;
(1R,2R,4aS,4bR,6aS,10aS,10bR,12aS)-2,4b,7,7,10a,12a-Hexamethyl-1-[(3R)-3-(4-methylcyclohexa-1,4-dien-1-yl)butyl]octadecahydrochrysen-2-ol
Formula
C35H58O
Exact mass
494.4488
Mol weight
494.83
Structure
Mol file
KCF file
DB search
Reaction
R10269
Enzyme
4.2.1.137
Other DBs
PubChem:
163312212
LinkDB
All DBs
KCF data
Show
ATOM 36
1 C1x C 9.2400 -18.6200
2 C1x C 9.2400 -20.0200
3 C1z C 10.4524 -20.7200
4 C1y C 11.6649 -20.0200
5 C1z C 11.6649 -18.6200
6 C1x C 10.4524 -17.9200
7 C1x C 12.8773 -20.7200
8 C1x C 14.0897 -20.0200
9 C1z C 14.0897 -18.6200
10 C1y C 12.8773 -17.9200
11 C1y C 15.3022 -17.9200
12 C1z C 15.3022 -16.5200
13 C1x C 14.0897 -15.8200
14 C1x C 12.8773 -16.5200
15 C1x C 16.5146 -18.6200
16 C1x C 17.7270 -17.9200
17 C1z C 17.7270 -16.5200
18 C1y C 16.5146 -15.8200
19 C1a C 9.7524 -22.0024
20 C1a C 11.1524 -22.0024
21 C1a C 11.6649 -17.2202
22 C1a C 13.6697 -17.2200
23 C1a C 15.3022 -15.1200
24 C1b C 16.5235 -14.4200
25 C1b C 17.7376 -13.7230
26 C1c C 17.7411 -12.3230
27 C2y C 18.9552 -11.6260
28 C1x C 20.1743 -12.3339
29 C2x C 21.3885 -11.6370
30 C2y C 21.3920 -10.2370
31 C1x C 20.1730 -9.5291
32 C2x C 18.9588 -10.2260
33 C1a C 22.6346 -9.5238
34 C1a C 16.5060 -11.6056
35 C1a C 18.4270 -15.3076
36 O1a O 19.1270 -16.5200
BOND 40
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 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 17 18 1
21 12 18 1
22 3 19 1
23 3 20 1
24 5 21 1 #Up
25 9 22 1 #Up
26 12 23 1 #Up
27 18 24 1 #Up
28 24 25 1
29 25 26 1
30 26 27 1
31 27 28 1
32 28 29 1
33 29 30 2
34 30 31 1
35 31 32 1
36 27 32 2
37 30 33 1
38 26 34 1 #Up
39 17 35 1 #Up
40 17 36 1 #Down
» Japanese version
DBGET
integrated database retrieval system
