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77875-70-8
BETA-ENDORPHIN (27-31) (HUMAN) ACETATE SALT
Name
BETA-ENDORPHIN (27-31) (HUMAN) ACETATE SALT
Formula
C28 H45 N7 O9 . C2 H4 O2
MolWeight
683.755
1Identification
【Name】
BETA-ENDORPHIN (27-31) (HUMAN) ACETATE SALT
【CAS】
【MDL】
MFCD00236973
【English Synonyms】
【Formula】
C28 H45 N7 O9 . C2 H4 O2
【MolWeight】
683.755
【Inchi】
InChI=1S/C28H45N7O9.C2H4O2/c29-13-3-1-5-20(26(41)32-16-23(37)33-22(28(43)44)11-12-24(38)39)35-27(42)21(6-2-4-14-30)34-25(40)19(31)15-17-7-9-18(36)10-8-17;1-2(3)4/h7-10,19-22,36H,1-6,11-16,29-31H2,(H,32,41)(H,33,37)(H,34,40)(H,35,42)(H,38,39)(H,43,44);1H3,(H,3,4)/t19-,20-,21-,22-;/m0./s1
【InChIKey】
InChIKey=NCPCDMTYCTXCEC-JZVQUOAUSA-N
【SMILES】
CC(=O)O.c1cc(ccc1C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)N)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:10
H bond acceptor:16
XLogP3:-2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BETA-ENDORPHIN (27-31) (HUMAN) ACETATE SALT.cml
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