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zifanocyclinum - CAS 1420294-56-9

zifanocyclinum is a tetracycline antibiotic

Catalog Number: I038694

CAS Number: 1420294-56-9

Molecular Formula: C29H36N4O7

Molecular Weight:552.63

Purity: 98.0%

Appearance:Solid powder

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* For research use only. Not for human or veterinary use.

Synonym

Synonymszifanocyclinum; zifanocycline

Property

Molecular Formula: C29H36N4O7
Molecular Weight552.63
SolubilityTo be determined
Purity98.0%
StorageDry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Computed Descriptor

IUPAC Name(4S,4aS,5aR,12aS)-9-[(3-azabicyclo[3.1.0]hexan-3- yl)methyl]-4,7-bis(dimethylamino)-3,10,12,12atetrahydroxy- 1,11-dioxo-1,4,4a,5,5a,6,11,12aoctahydrotetracene- 2-carboxamide
InChIInChI=1S/C29H36N4O7/c1-31(2)18-8-15(11-33-9-13-5-14(13)10-33)23(34)20-16(18)6-12-7-17-22(32(3)4)25(36)21(28(30)39)27(38)29(17,40)26(37)19(12)24(20)35/h8,12-14,17,22,34,36-37,40H,5-7,9-11H2,1-4H3,(H2,30,39)/t12-,13?,14?,17-,22-,29-/m0/s1
InChIKeyYOOGAONNHXDMEQ-OMBSCLNISA-N
SMILESO=C1C2=C(O)C(CN3CC4CC4C3)=CC(N(C)C)=C2C[C@@](C1=C5O)([H])C[C@]6([H])[C@@]5(O)C(C(C(N)=O)=C(O)[C@H]6N(C)C)=O