(7R,8R,9R,12Z,14S,15R,16S,17Z)-20-[(2S,3R,4S,5R,6R)-6-methoxy-4-(methoxymethoxy)-3,5-dimethyl-oxan-2-yl]-9,15-bis[(4-methoxyphenyl)methoxy]-6,6,8,14,16-pentamethyl-icosa-12,17-dien-7-ol

Systemtic Name: (7R,8R,9R,12Z,14S,15R,16S,17Z)-20-[(2S,3R,4S,5R,6R)-6-methoxy-4-(methoxymethoxy)-3,5-dimethyl-oxan-2-yl]-9,15-bis[(4-methoxyphenyl)methoxy]-6,6,8,14,16-pentamethyl-icosa-12,17-dien-7-ol Openeye Name: (7R,8R,9R,12Z,14S,15R,16S,17Z)-20-[(2S,3R,4S,5R,6R)-6-methoxy-4-(methoxymethoxy)-3,5-dimethyl-tetrahydropyran-2-yl]-9,15-bis[(4-methoxyphenyl)methoxy]-6,6,8,14,16-pentamethyl-icosa-12,17-dien-7-ol CAS Name: (7R,8R,9R,12Z,14S,15R,16S,17Z)-20-[(2S,3R,4S,5R,6R)-6-methoxy-4-(methoxymethoxy)-3,5-dimethyl-2-oxanyl]-9,15-bis[(4-methoxyphenyl)methoxy]-6,6,8,14,16-pentamethyl-7-eicosa-12,17-dienol IUPAC Name: (7R,8R,9R,12Z,14S,15R,16S,17Z)-20-[(2S,3R,4S,5R,6R)-6-methoxy-4-(methoxymethoxy)-3,5-dimethyloxan-2-yl]-9,15-bis[(4-methoxyphenyl)methoxy]-6,6,8,14,16-pentamethylicosa-12,17-dien-7-ol Traditional Name: (7R,8R,9R,12Z,14S,15R,16S,17Z)-20-[(2S,3R,4S,5R,6R)-6-methoxy-4-(methoxymethoxy)-3,5-dimethyl-tetrahydropyran-2-yl]-6,6,8,14,16-pentamethyl-9,15-bis(p-anisyloxy)eicosa-12,17-dien-7-ol Formula: C51H82O9 MolecularWeight: 839.19138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C(C(C)C(CCC=CC(C)C(C(C)C=CCCC1C(C(C(C(O1)OC)C)OCOC)C)OCC2=CC=C(C=C2)OC)OCC3=CC=C(C=C3)OC)O

Isomeric SMILES

CCCCCC(C)(C)[C@@H]([C@@H](C)[C@@H](CC/C=C\[C@H](C)[C@H]([C@@H](C)/C=C\CC[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC)C)OCOC)C)OCC2=CC=C(C=C2)OC)OCC3=CC=C(C=C3)OC)O

InChI

InChI=1S/C51H82O9/c1-13-14-19-32-51(7,8)49(52)39(5)45(57-33-41-24-28-43(54-10)29-25-41)22-17-15-20-36(2)47(58-34-42-26-30-44(55-11)31-27-42)37(3)21-16-18-23-46-38(4)48(59-35-53-9)40(6)50(56-12)60-46/h15-16,20-21,24-31,36-40,45-50,52H,13-14,17-19,22-23,32-35H2,1-12H3/b20-15-,21-16-/t36-,37-,38+,39-,40+,45+,46-,47+,48-,49+,50+/m0/s1