NEUROMEDIN B ,87096-84-2 _Chemical Cloud Database

NEUROMEDIN B

Basic Information
Product Name：	NEUROMEDIN B
CAS：	87096-84-2
English Synonyms：	GLY-ASN-LEU-TRP-ALA-THR-GLY-HIS-PHE-MET-NH2 ; NEUROMEDIN B ≥90% ; NEUROMEDIN B, PORCINE ; NEUROMEDIN B ; H-GLY-ASN-LEU-TRP-ALA-THR-GLY-HIS-PHE-MET-NH2 ; GNLWATGHFM-NH2
MDL Number.：	MFCD00167607
H bond acceptor：	27
H bond donor：	15
Smile：	CC(C)C[C@@H](C(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N[C@@H](Cc3c[nH]cn3)C(=O)N[C@@H](Cc4ccccc4)C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)CN
InChi：	InChI=1S/C52H73N15O12S/c1-27(2)17-36(64-51(78)40(21-41(54)69)61-42(70)22-53)48(75)66-38(19-31-23-57-34-14-10-9-13-33(31)34)47(74)60-28(3)46(73)67-44(29(4)68)52(79)58-25-43(71)62-39(20-32-24-56-26-59-32)50(77)65-37(18-30-11-7-6-8-12-30)49(76)63-35(45(55)72)15-16-80-5/h6-14,23-24,26-29,35-40,44,57,68H,15-22,25,53H2,1-5H3,(H2,54,69)(H2,55,72)(H,56,59)(H,58,79)(H,60,74)(H,61,70)(H,62,71)(H,63,76)(H,64,78)(H,65,77)(H,66,75)(H,67,73)/t28-,29+,35-,36-,37-,38-,39-,40-,44-/m0/s1
InChiKey：	InChIKey=YPFNACALNKVZNK-MFNIMNRCSA-N
Property
Safety information
WGK Germany：	3

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