Formula |
C32H49NO6 |
IUPAC Name |
(3beta,5beta,6beta,7beta,17alpha,22e)-7-hydroxy-3-[(2-methylalanyl)oxy]-5,6-epoxyergosta-8(14),22-dien-18-oic acid |
Molecular Mass |
543.735 g·mol−1 |
Heat of Formation |
-1198.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.06 ± 1.08 D |
Volume |
696.62 Å 3 |
Surface Area |
530.03 Å 2 |
HOMO Energy |
-9.30 ± 0.55 eV |
LUMO Energy |
3.83 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- ergokonin c
- ergosta-8(14),22-dien-18-oic acid, 3-(2-amino-2-methyl-1-oxopropoxy)-5,6-epoxy-7-hydroxy-, (3beta,5alpha,6alpha,7beta,22e)-
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CAS Number(s) |
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InChIKey |
YYOVEXZGHBXNOO-FLBCEDPUSA-N |
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Links |
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Elements |
H
C
O
N
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