 Home > Encyclopedia > Heptanoic acid, 3-hydroxy-4-((8-(((3-beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methyl-, (S-(R*,R*))-

Heptanoic acid, 3-hydroxy-4-((8-(((3-beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methyl-, (S-(R,R))-

Heptanoic acid, 3-hydroxy-4-((8-(((3-beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methyl-, (S-(R*,R*))- structure

CAS No:
150840-75-8
Formula:
C46H78N2O6
Chemical Name:
Heptanoic acid, 3-hydroxy-4-((8-(((3-beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methyl-, (S-(R*,R*))-
Synonyms:
N'-(N-(3-hydroxylup-20(29)-en-28-oyl)-8-aminooctanoyl)-4-amino-3-hydroxy-6-methylheptanoic acid;RPR 103611;RPR-103611;Rpr 103611;Rpr-103611;150840-75-8;RPR103611;(3S,4S)-4-[8-[[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]octanoylamino]-3-hydroxy-6-methyl-heptanoic acid;CHEMBL7447;DTXSID10934100;(3S,4S)-4-[8-[[(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]octanoylamino]-3-hydroxy-6-methylheptanoic acid;(S-(R*,R*))-3-Hydroxy-4-((8-(((3-beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methylheptanoic acid;(S-(R*,R*))-3-Hydroxy-4-((8-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methylheptanoic acid;N'-(N-(3-Hydroxylup-20(29)-en-28-oyl)-8-aminooctanoyl)-4-amino-3-hydroxy-6-methylheptanoic acid;4-[(8-{[3,28-Dihydroxylup-20(29)-en-28-ylidene]amino}-1-hydroxyoctylidene)amino]-3-hydroxy-6-methylheptanoic acid;Heptanoic acid, 3-hydroxy-4-((8-(((3-beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methyl-, (S-(R*,R*))-;Heptanoic acid, 3-hydroxy-4-((8-(((3beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methyl-, (S-(R*,R*))-;Heptanoic acid, 3-hydroxy-4-[[8-[[(3.beta.)-3-hydroxy-28-oxolup-20(29)-en-28-yl]amino]-1-oxooctyl]amino]-6-methyl-, (3S,4S)-

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Heptanoic acid, 3-hydroxy-4-((8-(((3-beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methyl-, (S-(R,R))- Basic Attributes

Molecular Weight：

755.1 g/mol

Exact Mass：

754.58598821 g/mol

Characteristics

PSA：

136 Å²

Drug Information

MeSH Entry Terms：

N'-(N-(3-hydroxylup-20(29)-en-28-oyl)-8-aminooctanoyl)-4-amino-3-hydroxy-6-methylheptanoic acid

Computed Properties

Molecular Weight:755.1
XLogP3:10
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:16
Exact Mass:754.58598821
Monoisotopic Mass:754.58598821
Topological Polar Surface Area:136
Heavy Atom Count:54
Complexity:1380
Defined Atom Stereocenter Count:12
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Heptanoic acid, 3-hydroxy-4-((8-(((3-beta)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-1-oxooctyl)amino)-6-methyl-, (S-(R*,R*))-

Basic Attributes
Characteristics
Drug Information
Computed Properties
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