Vitas-M small molecule compound

30-(1-hydroxyethyl)-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-di(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
STL565832
SMILES C/C=C/CC(C(C1C(=O)NC(C(O)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 C62H111N11O13 MW 1218.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C62H111N11O13/c1-25-26-27-39(14)52(76)51-56(80)66-49(42(17)74)60(84)67(18)32-47(75)68(19)43(28-33(2)3)55(79)65-48(37(10)11)61(85)69(20)44(29-34(4)5)54(78)63-40(15)53(77)64-41(16)57(81)70(21)45(30-35(6)7)58(82)71(22)46(31-36(8)9)59(83)72(23)50(38(
InChIKey
JTOKYIBTLUQVQV-OCEACIFDSA-N
Synonyms

(E)33(1hydroxy2methylhex4en1yl)30(1hydroxyethyl)691824tetraisobutyl321diisopropyl147101215192528nonamethyl1471013161922252831undecaazacyclotritriacontan2581114172023262932undecaone
12922536
30(1hydroxyethyl)33((4E)1hydroxy2methylhex4en1yl)147101215192528nonamethyl691824tetrakis(2methylpropyl)321di(propan2yl)1471013161922252831undecaazacyclotritriacontane2581114172023262932undecone
30(1hydroxyethyl)33((E)1hydroxy2methylhex4enyl)147101215192528nonamethyl691824tetrakis(2methylpropyl)321di(propan2yl)1471013161922252831undecazacyclotritriacontane2581114172023262932undecone
CC=CCC(C(C1C(=O)NC(C(O)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
InChI=1SC62H111N11O13c125262739(14)52(76)5156(80)6649(42(17)74)60(84)67(18)3247(75)68(19)43(2833(2)3)55(79)6548(37(10)11)61(85)69(20)44(2934(4)5)54(78)6340(15)53(77)6441(16)57(81)70(21)45(3035(6)7)58(82)71(22)46(3136(8)9)59(83)72(23)50(38(12)13)62(86
MFCD18064768

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Available files

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