Formula |
C34H47IN2O10 |
IUPAC Name |
[(3r,4ar,5s,6s,6as,10s,10ar,10bs)-10,10b-dihydroxy-6-[2-[3-(4-hydroxy-3-(125i)iodanyl-phenyl)propanoylamino]ethylcarbamoyloxy]-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyl-5,6,6a,8,9,10-hexahydro-2h-benzo[f]chromen-5-yl] acetate |
Molecular Mass |
768.649 g·mol−1 |
Heat of Formation |
-1777.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.75 ± 1.08 D |
Volume |
811.33 Å 3 |
Surface Area |
605.83 Å 2 |
HOMO Energy |
-8.99 ± 0.55 eV |
LUMO Energy |
2.51 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-(3-iodo-4-hydroxyphenyl)propionamide derivative of 6-(2-aminoethyl)aminocarbonylforskolin
- 6-125i-hpp-fsk
- 6-i-hpp-fsk
- carbamic acid, (2-((3-(4-hydroxy-5-(iodo-125i)phenyl)-1-oxopropyl)amino)ethyl)-, 5-(acetyloxy)-3-ethenyldodecahydro-10,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-1h-naphtho(2,1-b)pyran-6-yl ester, (3r-(3alpha,4aabeta,5beta,6beta,6aalpha,10alpha,10abeta,10balpha))-
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CAS Number(s) |
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InChIKey |
LWLDYBWLIPVYGP-UZONJECRSA-N |
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