Synonym
Pervicoside B; Neothyoside C;
IUPAC/Chemical Name
sodium (3R,4S,5S,6S)-5-(((2R,3S,4R,5R,6R)-5-(((2R,3S,4S,5S,6R)-4-(((2S,3S,4S,5S,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-methoxytetrahydro-2H-pyran-2-yl)oxy)-3,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-(((3R,3aR,5aS,7aR,9S,11aR,11bS,13R,13aS)-13-hydroxy-3,5a,8,8,11a-pentamethyl-3-(4-methylpent-3-en-1-yl)-1-oxo-3a,4,5,5a,7,7a,8,9,10,11,11a,11b,12,13-tetradecahydro-1H,3H-naphtho[2',1':4,5]indeno[1,7a-c]furan-9-yl)oxy)tetrahydro-2H-pyran-3-yl sulfate
InChi Key
KQZXVZVRFIRDCU-ZOZDSXHMSA-M
InChi Code
InChI=1S/C54H86O25S.Na/c1-23(2)11-10-16-53(8)31-14-18-52(7)25-12-13-30-50(4,5)33(15-17-51(30,6)26(25)19-32(57)54(31,52)49(65)78-53)74-48-44(36(60)29(22-70-48)79-80(66,67)68)77-45-38(62)37(61)41(24(3)71-45)75-47-40(64)43(35(59)28(21-56)73-47)76-46-39(63)42(69-9)34(58)27(20-55)72-46;/h11-12,24,26-48,55-64H,10,13-22H2,1-9H3,(H,66,67,68);/q;+1/p-1/t24-,26-,27-,28-,29-,30+,31+,32-,33+,34+,35+,36-,37-,38+,39+,40+,41+,42+,43+,44+,45-,46+,47-,48+,51-,52+,53-,54+;/m1./s1
SMILES Code
CC1(C)[C@@H](O[C@@H]2OC[C@H]([C@H]([C@@H]2O[C@@H]3[C@H]([C@H]([C@H]([C@H](O3)C)O[C@@H]4[C@H]([C@H]([C@H]([C@H](O4)CO)O)O[C@@H]5O[C@H](CO)[C@H](O)[C@H](OC)[C@@H]5O)O)O)O)O)OS(=O)([O-])=O)CC[C@@]6(C)[C@H]1CC=C7[C@H]6C[C@@H](O)[C@@]8(C(O9)=O)[C@@]7(C)CC[C@H]8[C@@]9(C)CC/C=C(C)\C.[Na+]
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.03.00