CCCC(OC(CO)CN(C)C)O[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CCCC(C)C)[C@@]4(C)CC[C@@H]32)C1

Название: 3-Dimethylamino-2-(Cholest-5-en-3β-oxybutan-4-oxy)-1-propanol

IUPAC: 3-(dimethylamino)-2-[1-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]butoxy]propan-1-ol

SMILES: CCCC(OC(CO)CN(C)C)O[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CCCC(C)C)[C@@]4(C)CC[C@@H]32)C1

Canonical SMILES: CCCC(OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C)OC(CN(C)C)CO

Молекулярная формула: C36H65NO3

Молекулярная масса: 559.90

InChIKey: AHAAWSZAMSFJTR-QGVXOJBNSA-N

InChI:

InChI=1S/C36H65NO3/c1-9-11-34(40-29(24-38)23-37(7)8)39-28-18-20-35(5)27(22-28)14-15-30-32-17-16-31(26(4)13-10-12-25(2)3)36(32,6)21-19-33(30)35/h14,25-26,28-34,38H,9-13,15-24H2,1-8H3/t26-,28+,29?,30+,31-,32+,33+,34?,35+,36-/m1/s1

PubChem CID: 86608584 →

Синонимы

AHAAWSZAMSFJTR-QGVXOJBNSA-N3-Dimethylamino-2-(Cholest-5-en-3beta-oxybutan-4-oxy)-1-propanol

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