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Concept information

ترکیب اکسیژن ارگانیک > کربوکسامید > کربوکسامید ثانویه > N [(2S,4aS,12aS) 2 [2 [[(3S) 1 benzylpyrrolidin 3 yl]amino] 2 oxoethyl] 5 methyl 6 oxo 2,3,4,4a,12,12a hexahydropyrano[2,3 c][1,5]benzoxazopine 2carazocin 8
ترکیب اکسیژن ارگانیک > کربوکسامید > کربوکسامید سوم > N [(2S,4aS,12aS) 2 [2 [[(3S) 1 benzylpyrrolidin 3 yl]amino] 2 oxoethyl] 5 methyl 6 oxo 2,3,4,4a,12,12a hexahydropyrano[2,3 c][1,5]benzoxazopine 2carazocin 8

Preferred term

N [(2S,4aS,12aS) 2 [2 [[(3S) 1 benzylpyrrolidin 3 yl]amino] 2 oxoethyl] 5 methyl 6 oxo 2,3,4,4a,12,12a hexahydropyrano[2,3 c][1,5]benzoxazopine 2carazocin 8  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C32H36N6O5

inchi

  • InChI=1S/C32H36N6O5/c1-37-27-9-8-24(16-30(39)35-23-11-14-38(19-23)18-21-5-3-2-4-6-21)43-29(27)20-42-28-10-7-22(15-25(28)32(37)41)36-31(40)26-17-33-12-13-34-26/h2-7,10,12-13,15,17,23-24,27,29H,8-9,11,14,16,18-20H2,1H3,(H,35,39)(H,36,40)/t23-,24-,27-,29+/m0/s1

inchikey

  • HJSUWZUIIQDZFE-AECHJOTKSA-N

mass

  • 584.667

monoisotopicmass

  • 584.27472

smiles

  • CN1[C@H]2CC[C@H](O[C@@H]2COC3=C(C1=O)C=C(C=C3)NC(=O)C4=NC=CN=C4)CC(=O)N[C@H]5CCN(C5)CC6=CC=CC=C6

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:97450

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