CAS: 114451-31-9 - phenelfamycin E

Formula: C₆₅H₉₅NO₂₁

InChI: InChI=1/C65H95NO21/c1-13-14-18-29-51-64(7,8)61(72)62(84-53(70)32-43-26-19-17-20-27-43)65(74,87-51)44(63(73)66-31-24-23-25-38(2)58(78-12)39(3)47-33-45(67)46(83-47)28-21-15-16-22-30-52(68)69)37-79-54-35-49(76-10)59(41(5)81-54)86-56-36-50(77-11)60(42(6)82-56)85-55-34-48(75-9)57(71)40(4)80-55/h13-30,39-42,44-51,54-62,67,71-72,74H,31-37H2,1-12H3,(H,66,73)(H,68,69)/b14-13-,16-15+,24-23+,28-21+,29-18+,30-22+,38-25+/t39-,40+,41+,42+,44?,45+,46+,47?,48+,49+,50-,51-,54+,55+,56-,57-,58?,59?,60+,61-,62+,65+/m0/s1

Synonyms:

• Ganefromycin component (alpha)
• (2E,4E,6E)-7-((2R*,3R*,5R*)-5-(7-((3E,5E)-3-((O-2,6-Dideoxy-3-O-methyl-alpha-lyxo-hexopyranosyl-(1->4)-O-2,6-dideoxy-3-O-methyl-beta-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-3-O-methyl-alpha-lyxo-hexopyranosyl)oxy)-2-((2S*,3S*,4S*,6R*)-tetrahydro-2,3,4-trihydroxy-5,5-dimethyl-6-((1E,3Z)-1,3-pentadienyl)-2H-pyran-2-yl)propionamido)-2-methoxy-1,3-dimethyl-3,5-heptadienyl)tetrahydro-3-hydroxy-2-furyl)-2,4,6-heptatrienoic acid, 2(sup 3)-phenylacetate
• (2E,4E,6E)-7-[(2R,3R)-5-{(1S,3E,5E)-7-[(2-{(2R,3R,4R,6S)-2,4-dihydroxy-5,5-dimethyl-6-[(1E,3Z)-penta-1,3-dien-1-yl]-3-[(phenylacetyl)oxy]tetrahydro-2H-pyran-2-yl}-3-{[(2R,4R,6R)-5-{[(2S,4S,5R,6R)-5-{[(2R,4R,5S,6R)-5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}propanoyl)amino]-2-methoxy-1,3-dimethylhepta-3,5-dien-1-yl}-3-hydroxytetrahydrofuran-2-yl]hepta-2,4,6-trienoic acid (non-preferred name)

Benzeneacetic acid, (2R,3R,4R,6S)-2-[(1S)-2-[[(2E,4E,6S,7S)-7-[(2R,4S,5S)-5-[(1E,3E,5E)-6-carboxy-1,3,5-hexatrienyl]tetrahydro-4-hydroxy-2-furanyl]-6-methoxy-5-methyl-2,4-octadienyl]amino]-1-[[[O-2,6-dideoxy-3-O-methyl-α-L-lyxo-hexopyranosyl-(1→4)-O-2,6-dideoxy-3-O-methyl-β-L-ribo-hexopyranosyl-(1→4)-2,6-dideoxy-3-O-methyl-α-L-lyxo-hexopyranosyl]oxy]methyl]-2-oxoethyl]tetrahydro-2,4-dihydroxy-5,5-dimethyl-6-[(1E,3Z)-1,3-pentadienyl]-2H-pyran-3-yl ester (9CI)

CAS: 114451-31-9

• Formula: C₆₅H₉₅NO₂₁
• Molecular weight: 1226.4439