Isochondodendrine

Compound Structure:

Synonyms:

(11R,26R)-5,20-dimethoxy-10,25-dimethyl-2,17-dioxa-10,25-diazaheptacyclo[26.2.2.213,16.13,7.118,22.011,36.026,33]hexatriaconta-1(31),3(36),4,6,13,15,18(33),19,21,28(32),29,34-dodecaene-4,19-diol

Compound ID:

NMPC-1153

PubChem ID:

197726

Molecular Formula:

C36H38N2O6

Canonical SMILES:

CN1CCC2=CC(=C(C3=C2C1CC4=CC=C(C=C4)OC5=C6C(CC7=CC=C(O3)C=C7)N(CCC6=CC(=C5O)OC)C)O)OC

InChIKey:

XIOGHHPVBVXQIV-VSGBNLITSA-N

About the compound:

Properties:

Chemical and Physical Properties

Computed Properties

Property Name	Property Value
Molecular Weight	594.7 g/mol
XLogP3-AA	6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	2
Exact Mass	594.27298694 g/mol
Monoisotopic Mass	594.27298694 g/mol
Topological Polar Surface Area	83.9Å²
Heavy Atom Count	44
Formal Charge	0
Complexity	866
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source: PubChem

Source Species:

Triclisia subcordata

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