[5-[(Z)-1-acetyloxyheptacos-17-enyl]-2-[9-acetyloxy-32-[(2S,3R,6S)-2-methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-6-[(6R,10R)-6,10,14-trimethyl-2-[(6R,10R)-6,10,14-trimethyl-2-[(2R,5R)-5-[(6R,10R)-6,10,14-trimethyl-2-oxidanyl-pentadecan-2-yl]oxolan-2-yl]pentadecan-2-yl]oxy-pentadecan-2-yl]oxan-3-yl]oxy-dotriacontan-10-yl]oxy-3-methoxy-phenyl] ethanoate

Systemtic Name: [5-[(Z)-1-acetyloxyheptacos-17-enyl]-2-[9-acetyloxy-32-[(2S,3R,6S)-2-methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-6-[(6R,10R)-6,10,14-trimethyl-2-[(6R,10R)-6,10,14-trimethyl-2-[(2R,5R)-5-[(6R,10R)-6,10,14-trimethyl-2-oxidanyl-pentadecan-2-yl]oxolan-2-yl]pentadecan-2-yl]oxy-pentadecan-2-yl]oxan-3-yl]oxy-dotriacontan-10-yl]oxy-3-methoxy-phenyl] ethanoate Openeye Name: [5-[(Z)-1-acetoxyheptacos-17-enyl]-2-[1-(1-acetoxynonyl)-23-[(2S,3R,6S)-6-[(5R,9R)-1-[(5R,9R)-1-[(2R,5R)-5-[(5R,9R)-1-hydroxy-1,5,9,13-tetramethyl-tetradecyl]tetrahydrofuran-2-yl]-1,5,9,13-tetramethyl-tetradecoxy]-1,5,9,13-tetramethyl-tetradecyl]-2-methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]tetrahydropyran-3-yl]oxy-tricosoxy]-3-methoxy-phenyl] acetate CAS Name: acetic acid [5-[(Z)-1-acetyloxyheptacos-17-enyl]-2-[9-acetyloxy-32-[[(2S,3R,6S)-6-[(6R,10R)-2-[(6R,10R)-2-[(2R,5R)-5-[(6R,10R)-2-hydroxy-6,10,14-trimethylpentadecan-2-yl]-2-oxolanyl]-6,10,14-trimethylpentadecan-2-yl]oxy-6,10,14-trimethylpentadecan-2-yl]-2-methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3-oxanyl]oxy]dotriacontan-10-yl]oxy-3-methoxyphenyl] ester IUPAC Name: [5-[(Z)-1-acetyloxyheptacos-17-enyl]-2-[9-acetyloxy-32-[(2S,3R,6S)-6-[(6R,10R)-2-[(6R,10R)-2-[(2R,5R)-5-[(6R,10R)-2-hydroxy-6,10,14-trimethylpentadecan-2-yl]oxolan-2-yl]-6,10,14-trimethylpentadecan-2-yl]oxy-6,10,14-trimethylpentadecan-2-yl]-2-methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]oxan-3-yl]oxydotriacontan-10-yl]oxy-3-methoxyphenyl] acetate Traditional Name: acetic acid [5-[(Z)-1-acetoxyheptacos-17-enyl]-2-[1-(1-acetoxynonyl)-23-[(2S,3R,6S)-6-[(5R,9R)-1-[(5R,9R)-1-[(2R,5R)-5-[(5R,9R)-1-hydroxy-1,5,9,13-tetramethyl-tetradecyl]tetrahydrofuran-2-yl]-1,5,9,13-tetramethyl-tetradecoxy]-1,5,9,13-tetramethyl-tetradecyl]-2-methyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]tetrahydropyran-3-yl]oxy-tricosoxy]-3-methoxy-phenyl] ester Formula: C152H286O13 MolecularWeight: 2321.88944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=CCCCCCCCCCCCCCCCC(C1=CC(=C(C(=C1)OC)OC(CCCCCCCCCCCCCCCCCCCCCCOC2CCC(OC2(C)CCCC(C)CCCC(C)CCCC(C)C)C(C)(CCCC(C)CCCC(C)CCCC(C)C)OC(C)(CCCC(C)CCCC(C)CCCC(C)C)C3CCC(O3)C(C)(CCCC(C)CCCC(C)CCCC(C)C)O)C(CCCCCCCC)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCC/C=C\CCCCCCCCCCCCCCCC(C1=CC(=C(C(=C1)OC)OC(CCCCCCCCCCCCCCCCCCCCCCO[C@@H]2CC[C@H](O[C@@]2(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C(C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)OC(C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)[C@H]3CC[C@@H](O3)C(C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O)C(CCCCCCCC)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C152H286O13/c1-27-29-31-33-35-36-37-38-39-40-41-42-43-44-45-48-51-54-57-60-63-66-70-73-109-139(159-135(19)153)138-121-142(157-26)148(143(122-138)161-137(21)155)162-141(140(160-136(20)154)110-74-69-34-32-30-28-2)111-75-71-67-64-61-58-55-52-49-46-47-50-53-56-59-62-65-68-72-76-120-158-145-113-115-147(164-150(145,23)117-86-106-132(16)102-82-98-128(12)94-78-90-124(5)6)152(25,119-88-108-134(18)104-84-100-130(14)96-80-92-126(9)10)165-151(24,118-87-107-133(17)103-83-99-129(13)95-79-91-125(7)8)146-114-112-144(163-146)149(22,156)116-85-105-131(15)101-81-97-127(11)93-77-89-123(3)4/h39-40,121-134,139-141,144-147,156H,27-38,41-120H2,1-26H3/b40-39-/t127-,128-,129-,130-,131-,132-,133-,134-,139?,140?,141?,144-,145-,146-,147+,149?,150+,151?,152?/m1/s1