Try beta.chemspider
- Double-bond stereo
- 26 of 27 defined stereocentres
(4S,12R,16R,17R,18R,21S,22R,23S,24R,28R,29R,30R)-31-{(2R,3S,4R,5S,6R)-6-[(1S,5S,6S)-6-{(2S,4S,5S,6S)-6-[(1R,2R,3E,11E,13E)-14-Chloro-1,2-dihydroxy-3,11,13-tetradecatrien-1-yl]-4,5-dihydroxytetrahydro- 2H-pyran-2-yl}-1,5,6-trihydroxy-4-methylenehexyl]-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl}-1,4,8,12,17,18,22,23,24,29,30-undecahydroxy-16,21,28-trimethyl-6-hentriacontanone (non-preferred name)
C[C@H](CCC[C@H](CCCC(CC(=O)C[C@H](CCCO)O)O)O)[C@H]([C@@H](CC[C@H](C)[C@H]([C@H]([C@@H](CCC[C@@H](C)[C@H]([C@@H](C[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)[C@H](CCC(=C)[C@@H]([C@@H]([C@@H]2C[C@@H]([C@@H]([C@H](O2)[C@@H]([C@@H](/C=C/CCCCCC/C=C/C=C/Cl)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O
InChI=1S/C65H117ClO24/c1-37(19-15-21-41(68)22-17-23-42(69)33-44(71)34-43(70)24-18-32-67)53(78)47(74)29-27-39(3)55(80)57(82)45(72)26-16-20-38(2)54(79)49(76)35-52-61(86)62(87)63(88)64(89-52)48(75)30-28-40(4)56(81)60(85)51-36-50(77)59(84)65(90-51)58(83)46(73)25-13-11-9-7-5-6-8-10-12-14-31-66/h10,12-14,25,31,37-39,41-43,45-65,67-70,72-88H,4-9,11,15-24,26-30,32-36H2,1-3H3/b12-10+,25-13+,31-14+/t37-,38-,39+,41-,42?,43+,45-,46-,47-,48+,49-,50+,51+,52-,53-,54-,55-,56+,57+,58-,59+,60-,61-,62-,63+,64-,65-/m1/s1
UODHJGDHXQXXSD-CNHWDNEKSA-N
CSID:44210858, http://www.chemspider.com/Chemical-Structure.44210858.html (accessed 19:36, Jun 1, 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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