2-[3-[10,15,20-tris[3-[3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]-2,3,12,13,22,24-hexahydroporphyrin-5-yl]phenoxy]oxane-3,4,5-triol

Systemtic Name: 2-[3-[10,15,20-tris[3-[3,4,5-tris(oxidanyl)oxan-2-yl]oxyphenyl]-2,3,12,13,22,24-hexahydroporphyrin-5-yl]phenoxy]oxane-3,4,5-triol Openeye Name: 2-[3-[10,15,20-tris[3-(3,4,5-trihydroxytetrahydropyran-2-yl)oxyphenyl]-2,3,12,13,22,24-hexahydroporphyrin-5-yl]phenoxy]tetrahydropyran-3,4,5-triol CAS Name: 2-[3-[10,15,20-tris[3-[(3,4,5-trihydroxy-2-oxanyl)oxy]phenyl]-2,3,12,13,22,24-hexahydroporphyrin-5-yl]phenoxy]oxane-3,4,5-triol IUPAC Name: 2-[3-[10,15,20-tris[3-(3,4,5-trihydroxyoxan-2-yl)oxyphenyl]-2,3,12,13,22,24-hexahydroporphyrin-5-yl]phenoxy]oxane-3,4,5-triol Traditional Name: 2-[3-[10,15,20-tris[3-(3,4,5-trihydroxytetrahydropyran-2-yl)oxyphenyl]-2,3,12,13,22,24-hexahydroporphin-5-yl]phenoxy]tetrahydropyran-3,4,5-triol Formula: C64H66N4O20 MolecularWeight: 1211.22364

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC1=C(C3=CC=C(N3)C(=C4CCC(=N4)C(=C5C=CC(=C2C6=CC(=CC=C6)OC7C(C(C(CO7)O)O)O)N5)C8=CC(=CC=C8)OC9C(C(C(CO9)O)O)O)C1=CC(=CC=C1)OC1C(C(C(CO1)O)O)O)C1=CC(=CC=C1)OC1C(C(C(CO1)O)O)O

Isomeric SMILES

C1CC2=NC1=C(C3=CC=C(N3)C(=C4CCC(=N4)C(=C5C=CC(=C2C6=CC(=CC=C6)OC7C(C(C(CO7)O)O)O)N5)C8=CC(=CC=C8)OC9C(C(C(CO9)O)O)O)C1=CC(=CC=C1)OC1C(C(C(CO1)O)O)O)C1=CC(=CC=C1)OC1C(C(C(CO1)O)O)O

InChI

InChI=1S/C64H66N4O20/c69-45-25-81-61(57(77)53(45)73)85-33-9-1-5-29(21-33)49-37-13-15-39(65-37)50(30-6-2-10-34(22-30)86-62-58(78)54(74)46(70)26-82-62)41-17-19-43(67-41)52(32-8-4-12-36(24-32)88-64-60(80)56(76)48(72)28-84-64)44-20-18-42(68-44)51(40-16-14-38(49)66-40)31-7-3-11-35(23-31)87-63-59(79)55(75)47(71)27-83-63/h1-13,15,18,20-24,45-48,53-65,68-80H,14,16-17,19,25-28H2