Voclosporin G
Selected Variant
TRC-V608170-5MG
Size: 5 mg
Product Specifications
Synonyms
(3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-33-((1R,2R,E)-1-hydroxy-2-methylhepta-4,6-dien-1-yl)-6,9,18,24-tetraisobutyl-3,21-diisopropyl-1,4,7,10,12,15,19,25,28-nonamethyl-30-propyl-1,4,7,10,13,16,19,22,25,28,31-undecaazacyclotritriacontan-2,5,8,11,14,17,20,23,26,29,32-undecaone
Hazard Statement
No Data Available
Smiles
C[C@H](C/C=C/C=C)[C@H]([C@]1([H])N(C([C@@H](N(C([C@@H](N(C([C@@H](N(C([C@H](NC([C@@H](NC([C@@H](N(C([C@@H](NC([C@@H](N(C(CN(C([C@@H](NC1=O)CCC)=O)C)=O)C)CC(C)C)=O)C(C)C)=O)C)CC(C)C)=O)C)=O)C)=O)C)CC(C)C)=O)C)CC(C)C)=O)C)C(C)C)=O)C)O
Molecular Formula
C64 H113 N11 O12
Molecular Weight
1228.64852
InChI
InChI=1S/C64H113N11O12/c1-25-27-28-30-42(15)54(77)53-58(81)67-45(29-26-2)60(83)69(18)35-50(76)70(19)46(31-36(3)4)57(80)68-51(40(11)12)63(86)71(20)47(32-37(5)6)56(79)65-43(16)55(78)66-44(17)59(82)72(21)48(33-38(7)8)61(84)73(22)49(34-39(9)10)62(85)74(23)52(41(13)14)64(87)75(53)24/h25,27-28,36-49,51-54,77H,1,26,29-35H2,2-24H3,(H,65,79)(H,66,78)(H,67,81)(H,68,80)/b28-27+/t42-,43+,44-,45+,46+,47+,48+,49+,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-diisopropyl-1,4,7,10,12,15,19,25,28-nonamethyl-30-propyl-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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