Try beta.chemspider
- 12 of 12 defined stereocentres
(2alpha,5beta,7beta,10beta,13alpha)-4,10-Diacetoxy-1,7-dihydroxy-13-{[(2R,3S)-2-hydroxy-3-{[(4S)-4-methylhexanoyl]amino}-3-phenylpropanoyl]oxy}-9-oxo-5,20-epoxytax-11-en-2-yl benzoate - acetonitrile ( 1:1)
CC[C@H](C)CCC(=O)N[C@@H](c1ccccc1)[C@H](C(=O)O[C@H]2C[C@]3([C@H]([C@H]4[C@@]([C@H](C[C@@H]5[C@]4(CO5)OC(=O)C)O)(C(=O)[C@@H](C(=C2C)C3(C)C)OC(=O)C)C)OC(=O)c6ccccc6)O)O.CC#N
InChI=1S/C47H59NO14.C2H3N/c1-9-25(2)20-21-34(52)48-36(29-16-12-10-13-17-29)37(53)43(56)60-31-23-47(57)41(61-42(55)30-18-14-11-15-19-30)39-45(8,32(51)22-33-46(39,24-58-33)62-28(5)50)40(54)38(59-27(4)49)35(26(31)3)44(47,6)7;1-2-3/h10-19,25,31-33,36-39,41,51,53,57H,9,20-24H2,1-8H3,(H,48,52);1H3/t25-,31-,32-,33+,36-,37+,38+,39-,41-,45+,46-,47+;/m0./s1
AXPPRLKWMJBCHI-ZVJMJUFFSA-N
CSID:30653894, http://www.chemspider.com/Chemical-Structure.30653894.html (accessed 22:26, 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
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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