Try beta.chemspider
- Double-bond stereo
- 12 of 12 defined stereocentres
(3beta,16alpha,21beta,22alpha)-28-Acetoxy-3-hydroxy-16,22-dimethoxy-23-oxoolean-12-en-21-yl (2E)-2-methyl-2-butenoate
O=C[C@]4(C)[C@@H](O)CC[C@@]5([C@@H]1[C@@]([C@]2(\C(=C/C1)[C@H]3[C@]([C@H](OC)C2)(COC(=O)C)[C@@H](OC)[C@H](OC(=O)/C(=C/C)C)C(C)(C)C3)C)(C)CC[C@@H]45)C
InChI=1S/C39H60O8/c1-12-23(2)33(43)47-31-32(45-11)39(22-46-24(3)41)26(19-34(31,4)5)25-13-14-28-35(6)17-16-29(42)36(7,21-40)27(35)15-18-37(28,8)38(25,9)20-30(39)44-10/h12-13,21,26-32,42H,14-20,22H2,1-11H3/b23-12+/t26-,27+,28+,29-,30+,31-,32-,35-,36-,37+,38+,39-/m0/s1
IPMXVYANBUSXPG-DHGCJPGPSA-N
CSID:8253607, http://www.chemspider.com/Chemical-Structure.8253607.html (accessed 03:25, Jul 4, 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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