Vitas-M small molecule compound

33-[(4E)-1-hydroxy-2-methylhex-4-en-1-yl]-1,4,7,10,12,15,19,25,28-nonamethyl-6,9,18,24-tetrakis(2-methylpropyl)-3,21,30-tri(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecaazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone

Catalog ID
STL565848
SMILES C/C=C/CC(C(C1C(=O)NC(C(C)C)C(=O)N(C)CC(=O)N(C)C(CC(C)C)C(=O)NC(C(C)C)C(=O)N(C)C(CC(C)C)C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C63H113N11O12 MW 1216.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C63H113N11O12/c1-26-27-28-41(16)53(76)52-57(80)67-49(38(10)11)61(84)68(19)33-48(75)69(20)44(29-34(2)3)56(79)66-50(39(12)13)62(85)70(21)45(30-35(4)5)55(78)64-42(17)54(77)65-43(18)58(81)71(22)46(31-36(6)7)59(82)72(23)47(32-37(8)9)60(83)73(24)51(40(
InChIKey
ZNVBEWJRWHNZMK-CYYJNZCTSA-N
Synonyms

12782939
33((4E)1hydroxy2methylhex4en1yl)147101215192528nonamethyl691824tetrakis(2methylpropyl)32130tri(propan2yl)1471013161922252831undecaazacyclotritriacontane2581114172023262932undecone
33((E)1hydroxy2methylhex4enyl)147101215192528nonamethyl691824tetrakis(2methylpropyl)32130tri(propan2yl)1471013161922252831undecazacyclotritriacontane2581114172023262932undecone
CC=CC(C@H)(C((C@H)1C(=O)N(C@@H)(C(C)C)C(=O)N(C)CC(=O)N(C)(C@@H)(CC(C)C)C(=O)N(C@@H)(C(C)C)C(=O)N(C)(C@@H)(CC(C)C)C(=O)N(C@H)(C(=O)N(C@@H)(C(=O)N((C@H)(C(=O)N((C@H)(C(=O)N((C@H)(C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)O)C
InChI=1SC63H113N11O12c126272841(16)53(76)5257(80)6749(38(10)11)61(84)68(19)3348(75)69(20)44(2934(2)3)56(79)6650(39(12)13)62(85)70(21)45(3035(4)5)55(78)6442(17)54(77)6543(18)58(81)71(22)46(3136(6)7)59(82)72(23)47(3237(8)9)60(83)73(24)51(40(14)15)63(86
MFCD32651742

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Available files

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