(3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-33-[(Z,1R,2R)-1,6-dihydroxy-2-methyl-4-(oxolan-2-yl)hex-4-enyl]-30-ethyl-1,4,7,10,12,15,19,25,28-nonamethyl-6,9,18,24-tetrakis(2-methylpropyl)-3,21-dipropan-2-yl-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone
Molecular Formula:
C66H117N11O14
InChI: InChI=1/C66H117N11O14/c1-24-46-62(86)71(17)35-52(79)72(18)47(30-36(2)3)59(83)70-53(40(10)11)65(89)73(19)48(31-37(4)5)58(82)67-43(15)57(81)68-44(16)61(85)74(20)49(32-38(6)7)63(87)75(21)50(33-39(8)9)64(88)76(22)54(41(12)13)66(90)77(23)55(60(84)69-46)56(80)42(14)34-45(27-28-78)51-26-25-29-91-51/h27,36-44,46-51,53-56,78,80H,24-26,28-35H2,1-23H3,(H,67,82)(H,68,81)(H,69,84)(H,70,83)/t42-,43+,44-,46+,47+,48+,49+,50+,51u,53+,54+,55+,56-/m1/s1/f/h67-70H
InChIKey: InChIKey=ZHJUCKHXMUCZKO-PJFKKKITDO
SMILES: CCC1C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1)C(C(C)CC(=CCO)C2CCCO2)O)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C
Names:
(3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-33-[(Z,1R,2R)-1,6-dihydroxy-2-methyl-4-(oxolan-2-yl)hex-4-enyl]-30-ethyl-1,4,7,10,12,15,19,25,28-nonamethyl-6,9,18,24-tetrakis(2-methylpropyl)-3,21-dipropan-2-yl-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone
Registries:
PubChem CID 10102914
PubChem ID 15090329
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