| Entry |
|
|---|
| Name |
Asperlin (USAN) |
|---|
| Formula |
C10H12O5
|
|---|
| Exact mass |
212.0685
|
|---|
| Mol weight |
212.20
|
|---|
| Structure |
|
|---|
| Source |
Aspergillus nidulans [TAX: 162425]
|
|---|
| Class |
|
|---|
| Efficacy |
Antibacterial, Antineoplastic |
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antineoplastic
DG01677 Alkylating agent
DG01725 Epoxide
D02999 Asperlin
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 15
1 C1y C 12.5300 -16.5200
2 O7x O 12.5300 -17.9200
3 C7x C 13.7424 -18.6200
4 C2x C 14.9549 -17.9200
5 C2x C 14.9549 -16.5200
6 C1y C 13.7424 -15.8200
7 O6a O 13.7424 -20.0200
8 C1a C 16.1673 -14.4200
9 C7a C 14.9549 -13.7200
10 O7a O 13.7424 -14.4200
11 O6a O 14.9549 -12.3200
12 C1y C 11.3176 -15.8200
13 C1y C 10.1051 -16.5200
14 C1a C 8.8927 -15.8200
15 O2x O 10.1051 -15.1200
BOND 16
1 2 3 1
2 3 4 1
3 4 5 2
4 5 6 1
5 1 6 1
6 3 7 2
7 8 9 1
8 9 10 1
9 6 10 1
10 9 11 2
11 2 1 1
12 1 12 1
13 12 13 1
14 13 14 1
15 13 15 1
16 12 15 1
|
|---|
