COMPOUND: C04606
Help
Entry
C04606 Compound
Name
5-(3,4-Diacetoxybut-1-ynyl)-2,2'-bithiophene
Formula
C16H14O4S2
Exact mass
334.0334
Mol weight
334.41
Structure
Mol file
KCF file
DB search
Reaction
R04525
Enzyme
3.1.1.66
Other DBs
PubChem:
7198
ChEBI:
16013
KNApSAcK:
C00049955
NIKKAJI:
J410.279G
LinkDB
All DBs
KCF data
Show
ATOM 22
1 C3b C 24.9890 -20.6545
2 C3b C 23.8449 -20.0006
3 C1c C 22.7067 -19.3407
4 C1b C 21.5686 -20.0006
5 O7a O 22.7067 -18.0210
6 O7a O 20.4244 -19.3407
7 C7a C 19.2862 -20.0006
8 C1a C 18.1481 -19.3345
9 O6a O 19.2924 -21.3141
10 C8y C 26.2006 -19.9452
11 S2x S 27.5205 -20.3539
12 C8y C 28.3171 -19.2250
13 C8x C 27.4896 -18.1185
14 C8x C 26.1815 -18.5636
15 C8y C 29.7171 -19.2250
16 C8x C 30.5629 -20.3898
17 C8x C 31.9321 -19.9453
18 C8x C 31.9325 -18.5058
19 S2x S 30.5635 -18.0606
20 C7a C 21.4676 -17.2900
21 C1a C 20.2551 -17.9900
22 O6a O 21.4741 -15.8901
BOND 23
1 1 2 3
2 2 3 1
3 3 4 1
4 3 5 1
5 4 6 1
6 6 7 1
7 7 8 1
8 7 9 2
9 1 10 1
10 10 11 1
11 11 12 1
12 12 13 2
13 13 14 1
14 10 14 2
15 12 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 15 19 1
21 5 20 1
22 20 21 1
23 20 22 2
» Japanese version
DBGET
integrated database retrieval system