Penimepicycline

Molecular Formula: C₄₅H₅₆N₆O₁₄S

InChI: InChI=1/C29H38N4O9.C16H18N2O5S/c1-28(41)15-5-4-6-18(35)19(15)23(36)20-16(28)13-17-22(31(2)3)24(37)21(26(39)29(17,42)25(20)38)27(40)30-14-33-9-7-32(8-10-33)11-12-34;1-16(2)12(15(21)22)18-13(20)11(14(18)24-16)17-10(19)8-23-9-6-4-3-5-7-9/h4-6,16-17,22,30,34-36,40-42H,7-14H2,1-3H3;3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/b27-21-;/t16-,17-,22-,28+,29-;11-,12+,14-/m01/s1/f/h;17,21H

InChIKey: InChIKey=AEHQQAHTGCVTMF-AYCYSNPDDT
SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)O)C.CC1(C2CC3C(C(=O)C(=C(NCN4CCN(CC4)CCO)O)C(=O)C3(C(=O)C2=C(C5=C1C=CC=C5O)O)O)N(C)C)O

Names:
    Duamine
    EINECS 225-002-0
    Hydrocycline
    Mepicycline penicillinate
    Penetracyne
    Penimepiciclina [DCIT]
    Penimepicycline [DCF:INN]
    Penimepicycline
    Penimepicyclinum [INN-Latin]
    (2Z,4S,4aS,5aS,6S,12aS)-4-dimethylamino-6,10,11,12a-tetrahydroxy-2-[hydroxy-[[4-(2-hydroxyethyl)piperazin-1-yl]methylamino]methylidene]-6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione; (2R,5R,6S)-3,3-dimethyl-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
    4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-N-((4-(2-hydroxyethyl)-1-piperazinyl)methyl)-6-methyl-1,11-dioxo-2-naphthacenecarboxamide salt with phenoxymethylpenicillin

Registries:
    PubChem CID 5464323
    PubChem ID 214105