Geometry & MOs
Info
ID: |
45221 |
PubChem CID: |
10509638 |
Reduced: |
O14C45H52 (1) |
Stoich.: |
A14B45C52 (1) |
Weight, g/mol: |
821.41977 |
ΔHf, kcal/mol: |
-529.99 |
Dipole, Da: |
10.99 |
IP(EA), eV: |
-8.94(-0.64) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(2R,4S,5S,7R,10S,11R,12S,22S,23R,26S,28S)-10-acetyloxy-5,23,28-trihydroxy-4,16,16,29,29,30-hexamethyl-22-[(2-methylpropan-2-yl)oxycarbonylamino]-3,14,24-trioxo-8,13,25-trioxapentacyclo[24.3.1.04,11.07,10.012,28]triacont-1(30)-en-2-yl] acetate