(2S)-2-[(2R,3R,4S,5S)-4-methoxy-6-[(1S)-1-[(3S,5R,7S,8R)-7-methoxy-3-[(5S)-5-[(5S)-5-[(3S)-5-[(3S,4S,5R,6S)-4-methoxy-3,5,6-trimethyl-6-oxidanyl-oxan-2-yl]-3-methyl-oxolan-2-yl]-5-methyl-oxolan-2-yl]-5-methyl-oxolan-2-yl]-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]ethyl]-3,5-dimethyl-2-oxidanyl-oxan-2-yl]propanoic acid

Systemtic Name: (2S)-2-[(2R,3R,4S,5S)-4-methoxy-6-[(1S)-1-[(3S,5R,7S,8R)-7-methoxy-3-[(5S)-5-[(5S)-5-[(3S)-5-[(3S,4S,5R,6S)-4-methoxy-3,5,6-trimethyl-6-oxidanyl-oxan-2-yl]-3-methyl-oxolan-2-yl]-5-methyl-oxolan-2-yl]-5-methyl-oxolan-2-yl]-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]ethyl]-3,5-dimethyl-2-oxidanyl-oxan-2-yl]propanoic acid Openeye Name: (2S)-2-[(2R,3R,4S,5S)-2-hydroxy-6-[(1S)-1-[(3S,5R,7S,8R)-3-[(5S)-5-[(5S)-5-[(3S)-5-[(3S,4S,5R,6S)-6-hydroxy-4-methoxy-3,5,6-trimethyl-tetrahydropyran-2-yl]-3-methyl-tetrahydrofuran-2-yl]-5-methyl-tetrahydrofuran-2-yl]-5-methyl-tetrahydrofuran-2-yl]-7-methoxy-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]ethyl]-4-methoxy-3,5-dimethyl-tetrahydropyran-2-yl]propanoic acid CAS Name: (2S)-2-[(2R,3R,4S,5S)-2-hydroxy-6-[(1S)-1-[(3S,5R,7S,8R)-3-[(5S)-5-[(5S)-5-[(3S)-5-[(3S,4S,5R,6S)-6-hydroxy-4-methoxy-3,5,6-trimethyl-2-oxanyl]-3-methyl-2-oxolanyl]-5-methyl-2-oxolanyl]-5-methyl-2-oxolanyl]-7-methoxy-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]ethyl]-4-methoxy-3,5-dimethyl-2-oxanyl]propanoic acid IUPAC Name: (2S)-2-[(2R,3R,4S,5S)-2-hydroxy-6-[(1S)-1-[(3S,5R,7S,8R)-3-[(5S)-5-[(5S)-5-[(3S)-5-[(3S,4S,5R,6S)-6-hydroxy-4-methoxy-3,5,6-trimethyloxan-2-yl]-3-methyloxolan-2-yl]-5-methyloxolan-2-yl]-5-methyloxolan-2-yl]-7-methoxy-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]ethyl]-4-methoxy-3,5-dimethyloxan-2-yl]propanoic acid Traditional Name: (2S)-2-[(2R,3R,4S,5S)-2-hydroxy-6-[(1S)-1-[(3S,5R,7S,8R)-3-[(5S)-5-[(5S)-5-[(3S)-5-[(3S,4S,5R,6S)-6-hydroxy-4-methoxy-3,5,6-trimethyl-tetrahydropyran-2-yl]-3-methyl-tetrahydrofuran-2-yl]-5-methyl-tetrahydrofuran-2-yl]-5-methyl-tetrahydrofuran-2-yl]-7-methoxy-3,8-dimethyl-4,10-dioxaspiro[4.5]decan-9-yl]ethyl]-4-methoxy-3,5-dimethyl-tetrahydropyran-2-yl]propionic acid Formula: C48H82O14 MolecularWeight: 883.15628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(OC1C2(CCC(O2)C3(CCC(O3)C4(CCC5(O4)CC(C(C(O5)C(C)C6C(C(C(C(O6)(C(C)C(=O)O)O)C)OC)C)C)OC)C)C)C)C7C(C(C(C(O7)(C)O)C)OC)C

Isomeric SMILES

C[C@H]1CC(OC1[C@@]2(CCC(O2)[C@@]3(CCC(O3)[C@@]4(CC[C@@]5(O4)C[C@@H]([C@H](C(O5)[C@@H](C)C6[C@H]([C@@H]([C@H]([C@@](O6)([C@H](C)C(=O)O)O)C)OC)C)C)OC)C)C)C)C7[C@H]([C@@H]([C@H]([C@@](O7)(C)O)C)OC)C

InChI

InChI=1S/C48H82O14/c1-24-22-32(40-28(5)38(54-14)29(6)46(12,51)59-40)56-41(24)45(11)19-17-34(58-45)43(9)18-16-35(57-43)44(10)20-21-47(62-44)23-33(53-13)25(2)36(60-47)26(3)37-27(4)39(55-15)30(7)48(52,61-37)31(8)42(49)50/h24-41,51-52H,16-23H2,1-15H3,(H,49,50)/t24-,25+,26+,27+,28-,29+,30+,31+,32?,33-,34?,35?,36?,37?,38-,39-,40?,41?,43-,44-,45-,46-,47+,48+/m0/s1