3-Formylrifamycin
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3-Formylrifamycin
structure -
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CAS No:
13292-22-3
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Formula:
C38H47NO13
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Chemical Name:
3-Formylrifamycin
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Synonyms:
Rifamycin,3-formyl-;2,7-(Epoxypentadeca[1,11,13]trienimino)naphtho[2,1-b]furan-8-carboxaldehyde,1,2-dihydro-5,6,9,17,19,21-hexahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-1,11-dioxo-,21-acetate;2,7-(Epoxypentadeca[1,11,13]trienimino)naphtho[2,1-b]furan,rifamycin deriv.;3-Formylrifamycin;3-Formylrifamycin SV;3-Formylrifampicin SV;Rifaldehyde;NCI 145-635;Rifamycin AF;30627-90-8;71795-12-5;1195640-82-4
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CAS No:
Characteristics
218.38000
4.70460
1.37±0.1 g/cm3(Predicted)
180-185 °C (decomp)
855.4±65.0 °C(Predicted)
471.1±34.3 °C
1.633
-20°C Freezer, Under Inert Atmosphere
Safety Information
|Danger|H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|P273, P280, P305+P351+P338, P310, P391, and P501|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:725.8
XLogP3:4.9
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:4
Exact Mass:725.30474055
Monoisotopic Mass:725.30474055
Topological Polar Surface Area:218
Heavy Atom Count:52
Complexity:1410
Defined Atom Stereocenter Count:9
Undefined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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