Geometry & MOs
Info
ID: |
59182 |
PubChem CID: |
24775698 |
Reduced: |
NO3C27H45 (1) |
Stoich.: |
AB3C27D45 (1) |
Weight, g/mol: |
924.471865 |
ΔHf, kcal/mol: |
-171.52 |
Dipole, Da: |
6.01 |
IP(EA), eV: |
-8.53(0.1) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2R,4aS,4bR,6R,7R,10aR)-6-hydroxy-7-[(2S,4S,5R,6R)-4-methoxy-5-[(2S,4S,5R,6S)-4-methoxy-5-[(2S,4S,5R,6R)-4-methoxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-4b-methyl-2-(2-methylfuran-3-yl)-2,3,4,4a,5,6,7,8,10,10a-decahydrophenanthren-1-one