Try beta.chemspider
- 11 of 18 defined stereocentres
(3beta)-28-Hydroxy-28-oxoolean-12-en-3-yl 3-O-beta-D-allopyranosyl-beta-D-allopyranosiduronic acid
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC[C@@H](C5(C)C)O[C@H]6[C@@H]([C@@H]([C@@H]([C@H](O6)C(=O)O)O)O[C@H]7[C@@H]([C@@H]([C@@H]([C@H](O7)CO)O)O)O)O)C)C)C2C1)C)C(=O)O)C
InChI=1S/C42H66O14/c1-37(2)14-16-42(36(51)52)17-15-40(6)20(21(42)18-37)8-9-24-39(5)12-11-25(38(3,4)23(39)10-13-41(24,40)7)54-35-30(48)31(29(47)32(56-35)33(49)50)55-34-28(46)27(45)26(44)22(19-43)53-34/h8,21-32,34-35,43-48H,9-19H2,1-7H3,(H,49,50)(H,51,52)/t21?,22-,23?,24?,25+,26-,27-,28-,29+,30-,31-,32+,34+,35-,39?,40?,41?,42?/m1/s1
BQPYEFAVIPEQIK-HZXQODLSSA-N
CSID:4479179, http://www.chemspider.com/Chemical-Structure.4479179.html (accessed 10:34, May 2, 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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