(3Z,5Z,7Z,11Z,13Z)-21-{2,4-Dihydroxy-6-[2-({4-Hydroxy-5-[(5-Hydroxy-4-Methoxy-6-Methyltetrahydro-2H-Pyran-2-Yl)Oxy]-4,6-Dimethyltetrahydro-2H-Pyran-2-Yl}Oxy)-3-Methoxypropyl]-3,5-Dimethyltetrahydro-2H -Pyran-2-Yl}-10-[(3,4-Dihydroxy-5-Methoxy-6-Methyltetrahydro-2H-Pyran-2-Yl)Oxy]-17,20-Dihydroxy-18-Methoxy-3,5,7,9,13-Pentamethyloxacyclohenicosa-3,5,7,11,13-Pentaen-2-One
[CAS# 476647-30-0]

Identification

• Name: (3Z,5Z,7Z,11Z,13Z)-21-{2,4-Dihydroxy-6-[2-({4-Hydroxy-5-[(5-Hydroxy-4-Methoxy-6-Methyltetrahydro-2H-Pyran-2-Yl)Oxy]-4,6-Dimethyltetrahydro-2H-Pyran-2-Yl}Oxy)-3-Methoxypropyl]-3,5-Dimethyltetrahydro-2H -Pyran-2-Yl}-10-[(3,4-Dihydroxy-5-Methoxy-6-Methyltetrahydro-2H-Pyran-2-Yl)Oxy]-17,20-Dihydroxy-18-Methoxy-3,5,7,9,13-Pentamethyloxacyclohenicosa-3,5,7,11,13-Pentaen-2-One
• Synonyms: (3Z,5Z,7Z,11Z,13Z)-21-{2,4-Dihydroxy-6-[2-({4-hydroxy-5-[(5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-4,6-dimethyltetrahydro-2H-pyran-2-yl}oxy)-3-methoxypropyl]-3,5-dimethyltetrahydro-2H -pyran-2-yl}-10-[(3,4-dihydroxy-5-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-17,20-dihydroxy-18-methoxy-3,5,7,9,13-pentamethyloxacyclohenicosa-3,5,7,11,13-pentaen-2-on (non-preferred name); (3Z,5Z,7Z,11Z,13Z)-21-{2,4-Dihydroxy-6-[2-({4-hydroxy-5-[(5-hydroxy-4-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-4,6-dimethyltetrahydro-2H-pyran-2-yl}oxy)-3-methoxypropyl]-3,5-dimethyltetrahydro-2H -pyran-2-yl}-10-[(3,4-dihydroxy-5-methoxy-6-methyltetrahydro-2H-pyran-2-yl)oxy]-17,20-dihydroxy-18-methoxy-3,5,7,9,13-pentamethyloxacyclohenicosa-3,5,7,11,13-pentaen-2-one (non-preferred name); (3Z,5Z,7Z,11Z,13Z)-21-{2,4-Dihydroxy-6-[2-({4-hydroxy-5-[(5-hydroxy-4-méthoxy-6-méthyltétrahydro-2H-pyran-2-yl)oxy]-4,6-diméthyltétrahydro-2H-pyran-2-yl}oxy)-3-méthoxypropyl]-3,5-diméthyltétrahydro-2H -pyran-2-yl}-10-[(3,4-dihydroxy-5-méthoxy-6-méthyltétrahydro-2H-pyran-2-yl)oxy]-17,20-dihydroxy-18-méthoxy-3,5,7,9,13-pentaméthyloxacyclohenicosa-3,5,7,11,13-pentaén-2-one (non-preferred name)
• Molecular Formula: C₅₈H₉₆O₂₁
• Molecular Weight: 1129.37
• CAS Registry Number: 476647-30-0
• SMILES: CC1/C=C(\C=C(/C=C(\C(=O)OC(C(CC(C(CC/C=C(\C=C/C1OC2C(C(C(C(O2)C)OC)O)O)/C)O)OC)O)C3(C(C(C(C(O3)CC(COC)OC4CC(C(C(O4)C)OC5CC(C(C(O5)C)O)OC)(C)O)C)O)C)O)/C)\C)/C
• InChI: 1S/C58H96O21/c1-29-17-16-18-40(59)44(69-13)25-41(60)54(78-55(65)33(5)23-31(3)21-30(2)22-32(4)42(20-19-29)76-56-51(64)50(63)52(71-15)37(9)74-56)58(67)35(7)48(61)34(6)43(79-58)24-39(28-68-12)75-47-27-57(11,66)53(38(10)73-47)77-46-26-45(70-14)49(62)36(8)72-46/h17,19-23,32,34-54,56,59-64,66-67H,16,18,24-28H2,1-15H3/b20-19-,29-17-,30-22-,31-21-,33-23-
• InChIKey: BGIXVQPJBLGABA-BNPGMBDQSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 1109.3±65.0°C at 760 mmHg (Cal.)
• Flash point: 295.4±27.8°C (Cal.)
• Refractive index: 1.563 (Cal.)