CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)NCCCCCC(=O)N5CC(CC5C(C6=CC=CC=C6)OC(C7=CC=C(C=C7)OC)C8=CC=C(C=C8)OC)O)C)C
이름: [17-[5-(dioctadecylamino)-5-oxopentan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[6-[2-[bis(4-methoxyphenyl)methoxy-phenylmethyl]-4-hydroxypyrrolidin-1-yl]-6-oxohexyl]carbamate
SMILES: CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)NCCCCCC(=O)N5CC(CC5C(C6=CC=CC=C6)OC(C7=CC=C(C=C7)OC)C8=CC=C(C=C8)OC)O)C)C

Molecular Processing

Molecular formula
C93H151N3O8
Molecular weight
1439.24
Exact mass
1438.1501
XLogP
24.59
TPSA
126.87
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
53
Heavy atoms
104
Rings
8
Aromatic rings
3
Saturated rings
5
Aliphatic rings
5
Stereo centers
12
Undefined stereo
12
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.774
Molar refractivity
430.25

Supplementary Information

InChIKey: SYFIZTGTNABJII-UHFFFAOYSA-N
동의어
SYFIZTGTNABJII-UHFFFAOYSA-N(6-{2-[Bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-hydroxy-pyrrolidin-1-yl}-6-oxo-hexyl)-carbamic acid 17-(3-dioctadecylcarbamoyl-1-methyl-propyl)-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-3-yl Ester
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