Colchicine, 10-(benzylamino)-10-demethoxy-

Modify Date: 2025-09-28 14:55:48

Colchicine, 10-(benzylamino)-10-demethoxy- Structure
Colchicine, 10-(benzylamino)-10-demethoxy- structure
Common Name Colchicine, 10-(benzylamino)-10-demethoxy-
CAS Number 76129-15-2 Molecular Weight 474.54800
Density 1.25g/cm3 Boiling Point 794.2ºC at 760 mmHg
Molecular Formula C28H30N2O5 Melting Point N/A
MSDS N/A Flash Point 434.1ºC

 Names

Name Acetamide, N-[5,6,7,9-tetrahydro-1,2,3-trimethoxy-9-oxo-10-[(phenylmethyl)amino]benzo[a]heptalen-7-yl]-, (S)
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.25g/cm3
Boiling Point 794.2ºC at 760 mmHg
Molecular Formula C28H30N2O5
Molecular Weight 474.54800
Flash Point 434.1ºC
Exact Mass 474.21500
PSA 85.89000
LogP 4.93900
Index of Refraction 1.622
InChIKey PDIUZPBNLUNFFJ-QFIPXVFZSA-N
SMILES COc1cc2c(c(OC)c1OC)-c1ccc(NCc3ccccc3)c(=O)cc1C(NC(C)=O)CC2

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AC8755000
CHEMICAL NAME :
Acetamide, N-(5,6,7,9-tetrahydro-1,2,3-trimethoxy-9-oxo-10-((phe nylmethyl)amino)benzo (a) heptalen-7-yl)-, (S)-
CAS REGISTRY NUMBER :
76129-15-2
BEILSTEIN REFERENCE NO. :
3185612
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C28-H30-N2-O5
MOLECULAR WEIGHT :
474.60
WISWESSER LINE NOTATION :
L B677 MV&T&J CO1 DO1 DO1 JMV1 NM1R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
25 mg/kg
TOXIC EFFECTS :
Tumorigenic - active as anti-cancer agent
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 24,636,1981

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

N-[(S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-benzylamino-9-oxobenzo[a]heptalen-7-yl]acetamide
N-<5,6,7,9-tetrahydro-1,2,3-trimethoxy-9-oxo-10-<(phenylmethyl)amino>benzo<a>heptalen-7-yl>-(S)-acetamide
10-(Benzylamino)-10-demethoxycolchicine
N-((S)-10-Benzylamino-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-acetamid
(S)-7-Acetylamino-10-benzylamino-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-on
N-((S)-10-benzylamino-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-acetamide
N-[(S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-9-oxo-10-benzylaminobenzo[a]heptalen-7-yl]acetamide
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