 Home > Encyclopedia > methyl (3S,5'aR,8'S,9'R,9'aS,10'aS)-8'-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,5a,6,7,8,9,9a,10,10a-decahydro-2H-pyrrolo[1,2-b]isoquinoline]-9'-carboxylate

methyl (3S,5'aR,8'S,9'R,9'aS,10'aS)-8'-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,5a,6,7,8,9,9a,10,10a-decahydro-2H-pyrrolo[1,2-b]isoquinoline]-9'-carboxylate

methyl (3S,5'aR,8'S,9'R,9'aS,10'aS)-8'-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,5a,6,7,8,9,9a,10,10a-decahydro-2H-pyrrolo[1,2-b]isoquinoline]-9'-carboxylate structure

CAS No:
5074-58-8
Formula:
C21H26N2O4
Chemical Name:
methyl (3S,5'aR,8'S,9'R,9'aS,10'aS)-8'-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,5a,6,7,8,9,9a,10,10a-decahydro-2H-pyrrolo[1,2-b]isoquinoline]-9'-carboxylate
Synonyms:
Yohimbine oxindole;5074-58-8;Yohimbine Oxindole A;SCHEMBL19534798;DTXSID80964974;2-methyl-2-(1-phenylethyl)malonate;(1'S-(1'alpha,5'abeta,8'alpha,9'alpha,9'aalpha,10'aalpha))-Methyl 1,2,2',3',5'a,6',7',8',9',9'a,10',10'a-dodecahydro-8'-hydroxy-2-oxospiro(3H-indole-3,1'(5'H)-pyrrolo(1,2-b)isoquinoline)-9'-carboxylate;Methyl 2,17-dihydroxy-1,2-didehydro-17,18-cyclocorynoxan-16-carboxylate;(7S)-2-Oxo-17alpha-hydroxy-2,7-dihydro-2,3-seco-3,7-cycloyohimban-16alpha-carboxylic acid methyl ester;Spiro(3H-indole-3,1'(5'H)-pyrrolo(1,2-b)soquinoline)-9-carboxylic acid, 1,2,2',3',5'a,6',7',8',9',9'a,10',10'a-dodecahydro-8'-hydroxy-2-oxo-, methyl ester, (1'S,5'aR,8'S,9'R,9'aS,10'aS)-

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methyl (3S,5'aR,8'S,9'R,9'aS,10'aS)-8'-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,5a,6,7,8,9,9a,10,10a-decahydro-2H-pyrrolo[1,2-b]isoquinoline]-9'-carboxylate Basic Attributes

Molecular Weight：

370.4 g/mol

Exact Mass：

370.18925731 g/mol

Characteristics

PSA：

78.9 Å²

Computed Properties

Molecular Weight:370.4
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:370.18925731
Monoisotopic Mass:370.18925731
Topological Polar Surface Area:78.9
Heavy Atom Count:27
Complexity:640
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl (3S,5'aR,8'S,9'R,9'aS,10'aS)-8'-hydroxy-2-oxospiro[1H-indole-3,1'-3,5,5a,6,7,8,9,9a,10,10a-decahydro-2H-pyrrolo[1,2-b]isoquinoline]-9'-carboxylate

Basic Attributes
Characteristics
Computed Properties
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