Try beta.chemspider
- 31 of 31 defined stereocentres
3-O-[(2R,3S,4S)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-L-xylopyranosyl-(1->4)-6-deoxy-alpha-D-mannopyranosyl-(1->2)-1-O-[(2alpha,3alpha,5beta,8alpha,9beta,10alpha,14beta,16beta,17al pha,18alpha)-3-(beta-L-glucopyranosyloxy)-2,16,23,24-tetrahydroxy-28-oxoolean-12-en-28-yl]-alpha-D-arabinopyranose
CC1(C)CC[C@@]2([C@H](C1)C1=CC[C@@H]3[C@](C)(CC[C@@H]4C(CO)(CO)[C@H](O[C@H]5O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]5O)[C@H](O)C[C@]43C)[C@@]1(C)C[C@@H]2O)C(=O)O[C@H]1OC[C@@H](O)[C@@H](O)[C@@H]1O[C@H]1O[C@H](C)[C@@H](O[C@H]2OC[C@H](O)[C@@H](O[C@H]3OC[C@@](O)(CO)[C@@H]3O)[C@@H]2O)[C@H](O)[C@@H]1O
InChI=1S/C57H92O28/c1-23-40(81-45-39(72)41(28(64)18-76-45)82-49-43(73)56(75,21-61)22-78-49)36(69)38(71)46(79-23)83-42-33(66)27(63)17-77-48(42)85-50(74)57-12-11-51(2,3)13-25(57)24-7-8-30-52(4)14-26(62)44(84-47-37(70)35(68)34(67)29(16-58)80-47)55(19-59,20-60)31(52)9-10-53(30,5)54(24,6)15-32(57)65/h7,23,25-49,58-73,75H,8-22H2,1-6H3/t23-,25-,26-,27-,28+,29+,30+,31+,32+,33-,34+,35-,36-,37+,38+,39+,40-,41-,42+,43-,44-,45-,46-,47-,48-,49-,52+,53+,54+,56+,57+/m1/s1
CYBWUNOAQPMRBA-WPRHBHJXSA-N
CSID:82827218, http://www.chemspider.com/Chemical-Structure.82827218.html (accessed 21:23, 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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