- 6 of 6 defined stereocentres
3-Buten-1-yl [(1R,2R,6S,6aS,11bS,11cS)-6a-(allyloxy)-10-[2-(1-aziridinyl)ethoxy]-1,2-bis(4-hydroxybutyl)-4-{[(4-nitrobenzyl)oxy]imino}-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-6-yl][2-(2-hydroxy ethoxy)ethyl]carbamate
C=CCCOC(=O)N(CCOCCO)[C@H]1CC(=NOCc2ccc(cc2)[N+](=O)[O-])C3=C[C@@H]([C@H]([C@H]4[C@@H]3[C@@]1(Oc5c4cc(cc5)OCCN6CC6)OCC=C)CCCCO)CCCCO
InChI=1S/C47H64N4O12/c1-3-5-26-60-46(55)50(21-27-58-29-24-54)43-32-41(48-62-33-34-12-14-36(15-13-34)51(56)57)39-30-35(10-6-8-22-52)38(11-7-9-23-53)44-40-31-37(59-28-20-49-18-19-49)16-17-42(40)63-47(43,45(39)44)61-25-4-2/h3-4,12-17,30-31,35,38,43-45,52-54H,1-2,5-11,18-29,32-33H2/t35-,38+,43-,44+,45+,47+/m0/s1
AZHBGNDNXIWYCS-SNNGSKKASA-N
CSID:5066692, http://www.chemspider.com/Chemical-Structure.5066692.html (accessed 22:19, Apr 17, 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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