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| Name |
Trioxacarcin C |
EINECS | N/A |
| CAS No. | 81781-28-4 | Density | 1.2284 (rough estimate) |
| PSA | 269.58000 | LogP | 0.95230 |
| Solubility | N/A | Melting Point |
181.5°C (rough estimate) |
| Formula | C42H54 O20 | Boiling Point | 705.4°C (rough estimate) |
| Molecular Weight | 878.96 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intraperitoneal route. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
TrioxacarcinA, 7''-deoxo-7''-hydroxy-; Spiro[2,13-methano-10H-anthra[1,2-b]-1,3-dioxolo[4,5-d]pyran-14,2'-oxirane],trioxacarcin A deriv.; Antibiotic DC 45B2; Trioxacarcin C |
Trioxacarcin C Chemical Properties
Empirical Formula of Trioxacarcin C (CAS NO.81781-28-4): C42H54O20
Molecular Weight: 878.8662 g/mol
Structure of Trioxacarcin C (CAS NO.81781-28-4):
.png)
Canonical SMILES: CC1C(C(CC(O1)OC23C4C(C5=C(C=C6C(=C5O2)C(=C7C(=O)C(CC(C7=C6OC)OC8CC(C
(OC8)(C)OC(=O)C)(C)O)O)O)C)OC(C39CO9)(O4)C(OC)OC)O)(C(C)O)O
InChI: InChI=1S/C42H54O20/c1-16-10-21-27(31(48)29-28(32(21)51-7)23(11-22(45)30(29)47)57-20-13-37(5,49)38(6,54-14-20)58-19(4)44)33-26(16)34-35-41(60-33,39(15-55-39)42(61-34,62-35)36(52-8)53-9)59-25-12-24(46)40(50,17(2)43)18(3)56-25/h10,17-18,20,22-25,34-36,43,45-46,48-50H,11-15H2,1-9H3
InChIKey: KXLOPASAZGAWAW-UHFFFAOYSA-N
Trioxacarcin C Toxicity Data With Reference
| 1. | dni-mus:lym 139 nmol/L | JANTAJ Journal of Antibiotics. 36 (1983),1216. | ||
| 2. | oms-mus:lym 139 nmol/L | JANTAJ Journal of Antibiotics. 36 (1983),1216. | ||
| 3. | ipr-mus LD50:1 mg/kg | JANTAJ Journal of Antibiotics. 36 (1983),1216. |
Trioxacarcin C Safety Profile
Poison by intraperitoneal route. Mutation data reported. When heated to decomposition Trioxacarcin C (CAS NO.81781-28-4) emits acrid smoke and irritating fumes.
Trioxacarcin C Specification
Trioxacarcin C , its cas register number is 81781-28-4. It also can be called Trioxacarcin A, 7''-deoxo-7''-hydroxy- ; and Antibiotic DC 45B2 .
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