2-[[6-[6-[[1,3-bis(oxidanylidene)isoindol-2-yl]oxymethyl]-2-[[11-[[1,3-bis(oxidanylidene)isoindol-2-yl]oxymethyl]-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxidanylidene-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-4,5-bis(oxidanyl)oxan-3-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]methoxy]isoindole-1,3-dione

Systemtic Name: 2-[[6-[6-[[1,3-bis(oxidanylidene)isoindol-2-yl]oxymethyl]-2-[[11-[[1,3-bis(oxidanylidene)isoindol-2-yl]oxymethyl]-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxidanylidene-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-4,5-bis(oxidanyl)oxan-3-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]methoxy]isoindole-1,3-dione Openeye Name: 2-[[6-[6-[(1,3-dioxoisoindolin-2-yl)oxymethyl]-2-[[11-[(1,3-dioxoisoindolin-2-yl)oxymethyl]-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-4,5-dihydroxy-tetrahydropyran-3-yl]oxy-3,4-dihydroxy-tetrahydropyran-2-yl]methoxy]isoindoline-1,3-dione CAS Name: 2-[[6-[[6-[(1,3-dioxo-2-isoindolyl)oxymethyl]-2-[[11-[(1,3-dioxo-2-isoindolyl)oxymethyl]-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-4,5-dihydroxy-3-oxanyl]oxy]-3,4-dihydroxy-2-oxanyl]methoxy]isoindole-1,3-dione IUPAC Name: 2-[[6-[6-[(1,3-dioxoisoindol-2-yl)oxymethyl]-2-[[11-[(1,3-dioxoisoindol-2-yl)oxymethyl]-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-3,4-dihydroxyoxan-2-yl]methoxy]isoindole-1,3-dione Traditional Name: 2-[[6-[4,5-dihydroxy-2-[[14-keto-4,4,6a,6b,8a,11,14b-heptamethyl-11-(phthalimidooxymethyl)-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-(phthalimidooxymethyl)tetrahydropyran-3-yl]oxy-3,4-dihydroxy-tetrahydropyran-2-yl]methoxy]isoindoline-1,3-quinone Formula: C66H77N3O18 MolecularWeight: 1200.32688

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)CON5C(=O)C6=CC=CC=C6C5=O)O)O)OC7CC(C(C(O7)CON8C(=O)C9=CC=CC=C9C8=O)O)O)C)C(=O)C=C1C3(CCC2(C1CC(CC2)(C)CON1C(=O)C2=CC=CC=C2C1=O)C)C)C)C

Isomeric SMILES

CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)CON5C(=O)C6=CC=CC=C6C5=O)O)O)OC7CC(C(C(O7)CON8C(=O)C9=CC=CC=C9C8=O)O)O)C)C(=O)C=C1C3(CCC2(C1CC(CC2)(C)CON1C(=O)C2=CC=CC=C2C1=O)C)C)C)C

InChI

InChI=1S/C66H77N3O18/c1-61(2)46-20-23-66(7)53(43(71)28-40-41-30-62(3,24-25-63(41,4)26-27-65(40,66)6)33-83-69-58(79)38-18-12-13-19-39(38)59(69)80)64(46,5)22-21-47(61)86-60-52(51(74)50(73)45(85-60)32-82-68-56(77)36-16-10-11-17-37(36)57(68)78)87-48-29-42(70)49(72)44(84-48)31-81-67-54(75)34-14-8-9-15-35(34)55(67)76/h8-19,28,41-42,44-53,60,70,72-74H,20-27,29-33H2,1-7H3