Geometry & MOs
Info
ID: |
223331 |
PubChem CID: |
85334876 |
Reduced: |
O6I9C53H59 (1) |
Stoich.: |
A6B9C53D59 (1) |
Weight, g/mol: |
2040.938431 |
ΔHf, kcal/mol: |
-76.44 |
Dipole, Da: |
7.0 |
IP(EA), eV: |
-8.59(-1.76) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[3,4-dihydroxy-6-(hydroxymethyl)-5-[3-hydroxy-6-methyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxyoxan-2-yl] 10-[[5-acetamido-3-[3,4-dihydroxy-6-methyl-5-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,6-dihydroxyoxan-2-yl]methoxy]-3-[4-[3,4-dihydroxy-5-[6-hydroxy-2-(hydroxymethyl)-6-methylocta-2,7-dienoyl]oxy-6-methyloxan-2-yl]oxy-2-(hydroxymethyl)hexa-2,5-dienoyl]oxy-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate