Try beta.chemspider
- 18 of 19 defined stereocentres
(2S,3R,4S,5R)-2-{[(2S,3R,4S,5S)-3-Acetoxy-5-hydroxy-2-({(1aR,3aR,3bS,5aS,6S,7S,8aS,8bR,10R,10aR)-6-hydroxy-10-methoxy-3a,5a-dimethyl-6-[(2S)-3-oxo-2-hexanyl]hexadecahydrocyclopenta[a]cyclopropa[2,3]cy clopenta[1,2-f]naphthalen-7-yl}oxy)tetrahydro-2H-pyran-4-yl]oxy}-4,5-dihydroxytetrahydro-2H-pyran-3-yl 4-methoxybenzoate
CCCC(=O)[C@@H](C)[C@]1([C@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@@]45[C@@]3(CC[C@@H]4C5)C)OC)C)O[C@H]6[C@@H]([C@H]([C@H](CO6)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)OC(=O)c8ccc(cc8)OC)OC(=O)C)O
InChI=1S/C46H66O15/c1-8-9-31(48)23(2)46(53)35(19-30-28-18-34(55-7)45-20-26(45)14-16-43(45,4)29(28)15-17-44(30,46)5)59-42-39(58-24(3)47)37(33(50)22-57-42)61-41-38(36(51)32(49)21-56-41)60-40(52)25-10-12-27(54-6)13-11-25/h10-13,23,26,28-30,32-39,41-42,49-51,53H,8-9,14-22H2,1-7H3/t23-,26?,28-,29+,30+,32-,33+,34-,35+,36+,37+,38-,39-,41+,42+,43-,44+,45+,46-/m1/s1
DITBZUXGQKHIOQ-YXUMRWMFSA-N
CSID:20580394, http://www.chemspider.com/Chemical-Structure.20580394.html (accessed 23:53, Apr 26, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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