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- 2 of 2 defined stereocentres
(6S,9aR)-2-Allyl-N-benzyl-6-(4-hydroxybenzyl)-8-[(1-methyl-3-{methyl[2-(4-morpholinyl)ethyl]carbamoyl}-1H-indol-7-yl)methyl]-4,7-dioxohexahydro-2H-pyrazino[2,1-c][1,2,4]triazine-1(6H)-carboxamide
CN(CCN1CCOCC1)C(=O)C1=CN(C)C2=C1C=CC=C2CN1C[C@H]2N(C(=O)NCC3C=CC=CC=3)N(CC=C)CC(=O)N2[C@@H](CC2C=CC(O)=CC=2)C1=O
InChI=1S/C42H50N8O6/c1-4-17-48-29-38(52)49-36(24-30-13-15-33(51)16-14-30)41(54)47(28-37(49)50(48)42(55)43-25-31-9-6-5-7-10-31)26-32-11-8-12-34-35(27-45(3)39(32)34)40(53)44(2)18-19-46-20-22-56-23-21-46/h4-16,27,36-37,51H,1,17-26,28-29H2,2-3H3,(H,43,55)/t36-,37+/m0/s1
VDUNEFAIXQBADT-PQQNNWGCSA-N
CSID:129134164, http://www.chemspider.com/Chemical-Structure.129134164.html (accessed 10:40, Jun 16, 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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