Voclosporin D
Selected Variant
TRC-V678590-10MG
Size: 10 mg
Product Specifications
Hazard Statement
No Data Available
Smiles
O[C@H]([C@H](C)C/C=C/C=C)[C@H](N(C([C@H](C(C)C)N(C([C@@H](N(C)C([C@H](CC(C)C)N(C)C([C@@H](C)NC([C@@H](NC([C@H](CC(C)C)N(C)C([C@H](C(C)C)NC([C@H](CC(C)C)N(C)C(CN1C)=O)=O)=O)=O)C)=O)=O)=O)CC(C)C)=O)C)=O)C)C(N[C@@H](C(C)C)C1=O)=O
Molecular Formula
C64 H113 N11 O12
Molecular Weight
1228.64852
InChI
InChI=1S/C64H113N11O12/c1-26-27-28-29-42(16)54(77)53-58(81)68-50(39(10)11)62(85)69(19)34-49(76)70(20)45(30-35(2)3)57(80)67-51(40(12)13)63(86)71(21)46(31-36(4)5)56(79)65-43(17)55(78)66-44(18)59(82)72(22)47(32-37(6)7)60(83)73(23)48(33-38(8)9)61(84)74(24)52(41(14)15)64(87)75(53)25/h26-28,35-48,50-54,77H,1,29-34H2,2-25H3,(H,65,79)(H,66,78)(H,67,80)(H,68,81)/b28-27+/t42-,43+,44-,45+,46+,47+,48+,50+,51+,52+,53+,54-/m1/s1
Additionnal Information
IUPAC name: (3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-33-[(1R,2R,4E)-1-hydroxy-2-methyl-hepta-4,6-dienyl]-6,9,18,24-tetraisobutyl-3,21,30-triisopropyl-1,4,7,10,12,15,19,25,28-nonamethyl-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone
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