Octreotide Acetate Injection, a cyclic octapeptide prepared as a clear sterilized option of octreotide, acetate salt, in a buffered acetate remedy for administration by deep subcutaneous or intravenous shot. Octreotide Acetate Injection is available as: sterilized 1 mL single dose vials in 2 strengths, including 100 and 500 mcg octreotide. Each mL of the single dose vial additionally has: sodium chloride. 2 mg sodium acetate trihydrate, USP. 2 mg water for shot, USP. qs to 1 mL The molecular weight of octreotide acetate is 1019. 3 and its amino acid series is.
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https://dailymed.nlm.nih.gov/dailymed/drugInfo.cfm?setid=d6a9a800-889d-417f-b533-1913197d0...
CID | MolecularFormula | MolecularWeight | CanonicalSMILES | IsomericSMILES | InChI | InChIKey | IUPACName | XLogP | ExactMass | MonoisotopicMass | TPSA | Complexity | Charge | HBondDonorCount | HBondAcceptorCount | RotatableBondCount | HeavyAtomCount | IsotopeAtomCount | AtomStereoCount | DefinedAtomStereoCount | UndefinedAtomStereoCount | BondStereoCount | DefinedBondStereoCount | UndefinedBondStereoCount | CovalentUnitCount |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
448601 | C49H66N10O10S2 | 1019.2 | CC(C1C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)NC(=O)C(CC5=CC=CC=C5)N)C(=O)NC(CO)C(C)O)O | C[[email protected]]([[email protected]]1C(=O)N[[email protected]@H](CSSC[[email protected]@H](C(=O)N[[email protected]](C(=O)N[[email protected]@H](C(=O)N[[email protected]](C(=O)N1)CCCCN)CC2=CNC3=CC=CC=C32)CC4=CC=CC=C4)NC(=O)[[email protected]@H](CC5=CC=CC=C5)N)C(=O)N[[email protected]](CO)[[email protected]@H](C)O)O | InChI=1S/C49H66N10O10S2/c1-28(61)39(25-60)56-48(68)41-27-71-70-26-40(57-43(63)34(51)21-30-13-5-3-6-14-30)47(67)54-37(22-31-15-7-4-8-16-31)45(65)55-38(23-32-24-52-35-18-10-9-17-33(32)35)46(66)53-36(19-11-12-20-50)44(64)59-42(29(2)62)49(69)58-41/h3-10,13-18,24,28-29,34,36-42,52,60-62H,11-12,19-23,25-27,50-51H2,1-2H3,(H,53,66)(H,54,67)(H,55,65)(H,56,68)(H,57,63)(H,58,69)(H,59,64)/t28-,29-,34-,36+,37+,38-,39-,40+,41+,42+/m1/s1 | DEQANNDTNATYII-OULOTJBUSA-N | (4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-3-phenylpropanoyl]amino]-16-benzyl-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-7-[(1R)-1-hydroxyethyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide | 1 | 1018.44048069 | 1018.44048069 | 383 | 1740 | 0 | 13 | 14 | 17 | 71 | 0 | 10 | 10 | 0 | 0 | 0 | 0 | 1 |
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