Formula |
C33H35N3O7 |
IUPAC Name |
methyl (2e)-4-{[4-(2-{[(5alpha,6beta,14beta,18r)-3-hydroxy-6-methoxy-17-methyl-7,8-didehydro-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-18-yl]amino}-2-oxoethyl)phenyl]amino}-4-oxo-2-butenoate |
Molecular Mass |
585.647 g·mol−1 |
Heat of Formation |
-785.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.25 ± 1.08 D |
Volume |
669.29 Å 3 |
Surface Area |
546.28 Å 2 |
HOMO Energy |
-8.39 ± 0.55 eV |
LUMO Energy |
-1.16 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-butenoic acid, 4-((4-(2-(((5alpha,7alpha)-4,5-epoxy-3-hydroxy-6-methoxy-17-methyl-6,14-ethenomorphinan-7-yl)amino)-2-oxoethyl)phenyl)amino)-4-oxo-, methyl ester, (e)-
- 6,14-endotheno-7-alpha-(p-methylfumaroylaminophenylacetylamino)tetrahydroripavine
- nih 10364
- nih-10364
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CAS Number(s) |
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InChIKey |
FUFVUCQZNVJNPF-OJBUMXNHSA-N |
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Links |
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Elements |
H
C
O
N
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