(3E,5E,7E,13E,15E,17E)-5,9,15,19-tetraethyl-10,20-bis[4-[5-ethyl-2-methoxy-6-methyl-4-[6-methyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-oxan-2-yl]-3-oxidanyl-butan-2-yl]-1,11-dioxacycloicosa-3,5,7,13,15,17-hexaene-2,12-dione

Systemtic Name: (3E,5E,7E,13E,15E,17E)-5,9,15,19-tetraethyl-10,20-bis[4-[5-ethyl-2-methoxy-6-methyl-4-[6-methyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-oxan-2-yl]-3-oxidanyl-butan-2-yl]-1,11-dioxacycloicosa-3,5,7,13,15,17-hexaene-2,12-dione Openeye Name: (3E,5E,7E,13E,15E,17E)-10,20-bis[3-[4-(4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-5-ethyl-2-methoxy-6-methyl-tetrahydropyran-2-yl]-2-hydroxy-1-methyl-propyl]-5,9,15,19-tetraethyl-1,11-dioxacycloicosa-3,5,7,13,15,17-hexaene-2,12-dione CAS Name: (3E,5E,7E,13E,15E,17E)-10,20-bis[4-[4-[(4,5-dihydroxy-6-methyl-2-oxanyl)oxy]-5-ethyl-2-methoxy-6-methyl-2-oxanyl]-3-hydroxybutan-2-yl]-5,9,15,19-tetraethyl-1,11-dioxacycloeicosa-3,5,7,13,15,17-hexaene-2,12-dione IUPAC Name: (3E,5E,7E,13E,15E,17E)-10,20-bis[4-[4-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-5-ethyl-2-methoxy-6-methyloxan-2-yl]-3-hydroxybutan-2-yl]-5,9,15,19-tetraethyl-1,11-dioxacycloicosa-3,5,7,13,15,17-hexaene-2,12-dione Traditional Name: (3E,5E,7E,13E,15E,17E)-10,20-bis[3-[4-(4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-5-ethyl-2-methoxy-6-methyl-tetrahydropyran-2-yl]-2-hydroxy-1-methyl-propyl]-5,9,15,19-tetraethyl-1,11-dioxacycloeicosa-3,5,7,13,15,17-hexaene-2,12-quinone Formula: C64H104O18 MolecularWeight: 1161.49976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C=CC=C(C=CC(=O)OC(C(C=CC=C(C=CC(=O)OC1C(C)C(CC2(CC(C(C(O2)C)CC)OC3CC(C(C(O3)C)O)O)OC)O)CC)CC)C(C)C(CC4(CC(C(C(O4)C)CC)OC5CC(C(C(O5)C)O)O)OC)O)CC

Isomeric SMILES

CCC\1C(OC(=O)/C=C/C(=C/C=C/C(C(OC(=O)/C=C/C(=C/C=C1)/CC)C(C(O)CC2(OC(C(C(C2)OC3OC(C(C(C3)O)O)C)CC)C)OC)C)CC)/CC)C(C(O)CC4(OC(C(C(C4)OC5OC(C(C(C5)O)O)C)CC)C)OC)C

InChI

InChI=1S/C64H104O18/c1-15-43-23-21-25-45(17-3)61(37(7)51(67)33-63(73-13)35-53(47(19-5)39(9)81-63)77-57-31-49(65)59(71)41(11)75-57)80-56(70)30-28-44(16-2)24-22-26-46(18-4)62(79-55(69)29-27-43)38(8)52(68)34-64(74-14)36-54(48(20-6)40(10)82-64)78-58-32-50(66)60(72)42(12)76-58/h21-30,37-42,45-54,57-62,65-68,71-72H,15-20,31-36H2,1-14H3/b25-21+,26-22+,29-27+,30-28+,43-23+,44-24+