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Aristolactam

Aristolactam structure

CAS No:
13395-02-3
Formula:
C17H11NO4
Chemical Name:
Aristolactam
Synonyms:
Benzo[f]-1,3-benzodioxolo[6,5,4-cd]indol-5(6H)-one,8-methoxy-;8-Methoxybenzo[f]-1,3-benzodioxolo[6,5,4-cd]indol-5(6H)-one;Aristololactam;Aristolactam;Aristolactam I;Aristololactam I;NSC 87406
Categories:
Biochemical Engineering > Plant Extracts

Description

Aristololactam I (AL-I), is the main metabolite of aristolochic acid I (AA-I), participates in the processes that lead to renal damage.Aristololactam I (AL-I) directly injures renal proximal tubule cells, the cytotoxic potency of AL-I is higher than that of AA-I and that the cytotoxic effects of these molecules are mediated through the induction of apoptosis in a caspase-3-dependent pathway[1].

Aristolactam Basic Attributes

Molecular Weight：

293.278

Exact Mass：

293.27

NSC Number：

87406

DSSTox ID：

DTXSID60158430

HScode：

2933990090

Characteristics

PSA：

56.8

XLogP3：

2.97

Density：

1.49

Melting Point：

319 °C

Boiling Point：

463.9±34.0 °C(Predicted)

Flash Point：

234.4±25.7 °C

Refractive Index：

1.763

Vapor Pressure：

8.75E-09mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1(b)

Transport codes：

2811

Precautionary statement(s)：

P201, P202, P260, P262, P264, P270, P271, P280, P281, P284, P301+P310, P302+P350, P304+P340, P308+P313, P310, P320, P321, P322, P330, P361, P363, P403+P233, P405, P501

Hazard Statements：

H300

Drug Information

MeSH Entry Terms：

8-methoxy -6-nitrophenanthro(3,4-d)-1,3-dioxolo-5-carboxylic acid

Aristolactam Use and Manufacturing

Aristolactam I is a metabolite of Aristolochic acids which are natural nitro-compounds found globally in the plant genus Aristolochia, having carcinogenic effects.

Computed Properties

Molecular Weight:293.27
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:293.06880783
Monoisotopic Mass:293.06880783
Topological Polar Surface Area:56.8
Heavy Atom Count:22
Complexity:483
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Aristolactam

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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