Formula |
C24H32N4O8S |
IUPAC Name |
[4-[(2s)-2-[[(2s)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]-3-(methylamino)-3-oxo-propyl]phenyl]sulfamic acid |
Molecular Mass |
536.598 g·mol−1 |
Heat of Formation |
-1475.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.86 ± 1.08 D |
Volume |
629.81 Å 3 |
Surface Area |
466.5 Å 2 |
HOMO Energy |
-8.94 ± 0.55 eV |
LUMO Energy |
-0.19 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- [4-[(2s)-2-[[(2s)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]-3-keto-3-methylamino-propyl]phenyl]sulfamic acid
- [4-[(2s)-2-[[(2s)-2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylamino-3-oxo-propyl]phenyl]sulfamic acid
- [4-[(2s)-2-[[(2s)-2-[(tert-butoxy-oxomethyl)amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methylamino-3-oxopropyl]phenyl]sulfamic acid
- [4-[(2s)-2-[[(2s)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-methylamino-3-oxo-propyl]phenyl]sulfamic acid
- [4-[(2s)-2-[[(2s)-3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-methylamino-3-oxopropyl]phenyl]sulfamic acid
- n-(tert-butoxycarbonyl)-l-tyrosyl-n-methyl-4-(sulfoamino)-l-phenylalaninamide
- ua1
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InChIKey |
WHAYYJWTZOFXQG-PMACEKPBSA-N |
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Elements |
H
C
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O
N
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