N-(3-methoxy-1-oxidanyl-butan-2-yl)-N-methyl-4-[[(2E,4E,6E,8Z)-10-[[(4Z,6Z,8E)-2,2,4-trimethyl-10-(2-methyl-1,3-oxazol-5-yl)-3-oxidanyl-deca-4,6,8-trienoyl]amino]deca-2,4,6,8-tetraenoyl]amino]-1,3-dioxolane-4-carboxamide

Systemtic Name: N-(3-methoxy-1-oxidanyl-butan-2-yl)-N-methyl-4-[[(2E,4E,6E,8Z)-10-[[(4Z,6Z,8E)-2,2,4-trimethyl-10-(2-methyl-1,3-oxazol-5-yl)-3-oxidanyl-deca-4,6,8-trienoyl]amino]deca-2,4,6,8-tetraenoyl]amino]-1,3-dioxolane-4-carboxamide Openeye Name: N-[1-(hydroxymethyl)-2-methoxy-propyl]-4-[[(2E,4E,6E,8Z)-10-[[(4Z,6Z,8E)-3-hydroxy-2,2,4-trimethyl-10-(2-methyloxazol-5-yl)deca-4,6,8-trienoyl]amino]deca-2,4,6,8-tetraenoyl]amino]-N-methyl-1,3-dioxolane-4-carboxamide CAS Name: N-(1-hydroxy-3-methoxybutan-2-yl)-4-[[(2E,4E,6E,8Z)-10-[[(4Z,6Z,8E)-3-hydroxy-2,2,4-trimethyl-10-(2-methyl-5-oxazolyl)-1-oxodeca-4,6,8-trienyl]amino]-1-oxodeca-2,4,6,8-tetraenyl]amino]-N-methyl-1,3-dioxolane-4-carboxamide IUPAC Name: N-(1-hydroxy-3-methoxybutan-2-yl)-4-[[(2E,4E,6E,8Z)-10-[[(4Z,6Z,8E)-3-hydroxy-2,2,4-trimethyl-10-(2-methyl-1,3-oxazol-5-yl)deca-4,6,8-trienoyl]amino]deca-2,4,6,8-tetraenoyl]amino]-N-methyl-1,3-dioxolane-4-carboxamide Traditional Name: 4-[[(2E,4E,6E,8Z)-10-[[(4Z,6Z,8E)-3-hydroxy-2,2,4-trimethyl-10-(2-methyloxazol-5-yl)deca-4,6,8-trienoyl]amino]deca-2,4,6,8-tetraenoyl]amino]-N-(2-methoxy-1-methylol-propyl)-N-methyl-1,3-dioxolane-4-carboxamide Formula: C37H52N4O9 MolecularWeight: 696.83018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(O1)CC=CC=CC=C(C)C(C(C)(C)C(=O)NCC=CC=CC=CC=CC(=O)NC2(COCO2)C(=O)N(C)C(CO)C(C)OC)O

Isomeric SMILES

CC1=NC=C(O1)C/C=C/C=C\C=C(\C)/C(C(C)(C)C(=O)NC/C=C\C=C\C=C\C=C\C(=O)NC2(COCO2)C(=O)N(C)C(CO)C(C)OC)O

InChI

InChI=1S/C37H52N4O9/c1-27(19-15-12-13-16-20-30-23-39-29(3)50-30)33(44)36(4,5)34(45)38-22-18-14-10-8-9-11-17-21-32(43)40-37(25-48-26-49-37)35(46)41(6)31(24-42)28(2)47-7/h8-19,21,23,28,31,33,42,44H,20,22,24-26H2,1-7H3,(H,38,45)(H,40,43)/b10-8+,11-9+,15-12-,16-13+,18-14-,21-17+,27-19-