Try beta.chemspider
- 38 of 38 defined stereocentres
(3beta,5alpha,6alpha)-6-{[6-Deoxy-alpha-D-glucopyranosyl-(1->2)-[beta-D-galactopyranosyl-(1->3)-6-deoxy-beta-L-altropyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)]-beta-D-xylopyranosyl-(1->3)-6-deoxy -alpha-D-glucopyranosyl]oxy}-23-oxocholest-9(11)-en-3-yl hydrogen sulfate
CC1C(C(C(C(O1)OC2C(C(COC2OC3C(C(OC(C3O)OC4CC5C6CCC(C6(CC=C5C7(C4CC(CC7)OS(=O)(=O)O)C)C)C(C)CC(=O)CC(C)C)C)O)OC8C(C(C(C(O8)CO)O)O)OC9C(C(C(C(O9)C)O)OC1C(C(C(C(O1)CO)O)O)O)O)O)O)O)O
InChI=1S/C62H102O32S/c1-22(2)15-27(65)16-23(3)30-9-10-31-29-18-34(33-17-28(94-95(79,80)81)11-13-62(33,8)32(29)12-14-61(30,31)7)86-57-49(77)52(40(68)25(5)84-57)91-59-53(92-55-47(75)44(72)38(66)24(4)83-55)43(71)37(21-82-59)89-60-54(46(74)42(70)36(20-64)88-60)93-58-50(78)51(39(67)26(6)85-58)90-56-48(76)45(73)41(69)35(19-63)87-56/h12,22-26,28-31,33-60,63-64,66-78H,9-11,13-21H2,1-8H3,(H,79,80,81)/t23-,24-,25-,26+,28+,29+,30-,31+,33-,34+,35-,36-,37-,38-,39+,40-,41+,42+,43+,44+,45+,46+,47-,48-,49-,50-,51+,52+,53-,54-,55-,56+,57-,58-,59+,60+,61-,62-/m1/s1
OYUARXHQXRTSPL-LJJQMTCPSA-N
CSID:9095629, http://www.chemspider.com/Chemical-Structure.9095629.html (accessed 13:21, Jul 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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