(1S,3S)-3-(Chloroacetyl)-3,5,12-Trihydroxy-10-Methoxy-6,11-Dioxo-1,2,3,4,6,11-Hexahydro-1-Tetracenyl 3-Amino-2,3,6-Trideoxy-β-D-Glycero-Hexopyranoside

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Properties Simple | Detailed

Formula C27H28ClNO10
IUPAC Name (7s,9s)-7-[(2r,4s,5s,6r)-4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-9-(2-chloroacetyl)-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7h-tetracene-5,12-dione
Molecular Mass 561.965 g·mol−1
Heat of Formation -1628.6 ± 16.7 kJ·mol−1
Dipole Moment 8.46 ± 1.08 D
Volume 597.22 Å 3
Surface Area 477.42 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 1.12 ± eV
Point Group Symmetry C1
InChIKey YPCKPOWJKPVJRQ-ATLWJKPDSA-N
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Elements H C N O Cl