5-azanyl-5-[3-[bis[4-azanyl-2-oxidanyl-4-(4-oxidanylbutanoyl)dodecyl]amino]-2-oxidanyl-propyl]-1-oxidanyl-tridecan-4-one

Systemtic Name: 5-azanyl-5-[3-[bis[4-azanyl-2-oxidanyl-4-(4-oxidanylbutanoyl)dodecyl]amino]-2-oxidanyl-propyl]-1-oxidanyl-tridecan-4-one Openeye Name: 5-amino-5-[3-[bis[4-amino-2-hydroxy-4-(4-hydroxybutanoyl)dodecyl]amino]-2-hydroxy-propyl]-1-hydroxy-tridecan-4-one CAS Name: 5-amino-5-[3-[bis[4-amino-2-hydroxy-4-(4-hydroxy-1-oxobutyl)dodecyl]amino]-2-hydroxypropyl]-1-hydroxy-4-tridecanone IUPAC Name: 5-amino-5-[3-[bis[4-amino-2-hydroxy-4-(4-hydroxybutanoyl)dodecyl]amino]-2-hydroxypropyl]-1-hydroxytridecan-4-one Traditional Name: 5-amino-5-[3-[bis[4-amino-2-hydroxy-4-(4-hydroxybutanoyl)dodecyl]amino]-2-hydroxy-propyl]-1-hydroxy-tridecan-4-one Formula: C48H96N4O9 MolecularWeight: 873.29724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC(CN(CC(CC(CCCCCCCC)(C(=O)CCCO)N)O)CC(CC(CCCCCCCC)(C(=O)CCCO)N)O)O)(C(=O)CCCO)N

Isomeric SMILES

CCCCCCCCC(CC(CN(CC(CC(CCCCCCCC)(C(=O)CCCO)N)O)CC(CC(CCCCCCCC)(C(=O)CCCO)N)O)O)(C(=O)CCCO)N

InChI

InChI=1S/C48H96N4O9/c1-4-7-10-13-16-19-28-46(49,43(59)25-22-31-53)34-40(56)37-52(38-41(57)35-47(50,44(60)26-23-32-54)29-20-17-14-11-8-5-2)39-42(58)36-48(51,45(61)27-24-33-55)30-21-18-15-12-9-6-3/h40-42,53-58H,4-39,49-51H2,1-3H3