Benzo[h][1]benzopyrano[5,4,3-cde][1]benzopyran-5,12-dione,10-[[2-O-(2-amino-2,6-dideoxy-3-O-methyl-a-D-galactopyranosyl)-6-deoxy-3-C-methyl-b-D-galactopyranosyl]oxy]-6-hydroxy-1-methyl

Modify Date: 2025-08-27 18:43:18

Benzo[h][1]benzopyrano[5,4,3-cde][1]benzopyran-5,12-dione,10-[[2-O-(2-amino-2,6-dideoxy-3-O-methyl-a-D-galactopyranosyl)-6-deoxy-3-C-methyl-b-D-galactopyranosyl]oxy]-6-hydroxy-1-methyl structure	Common Name	Benzo[h][1]benzopyrano[5,4,3-cde][1]benzopyran-5,12-dione,10-[[2-O-(2-amino-2,6-dideoxy-3-O-methyl-a-D-galactopyranosyl)-6-deoxy-3-C-methyl-b-D-galactopyranosyl]oxy]-6-hydroxy-1-methyl
	CAS Number	97068-30-9	Molecular Weight	653.63000
	Density	1.57g/cm3	Boiling Point	913.2ºC at 760mmHg
	Molecular Formula	C₃₃H₃₅NO₁₃	Melting Point	N/A
	MSDS	N/A	Flash Point	506.1ºC

Name	Benzo[h][1]benzopyrano[5,4,3-cde][1]benzopyran-5,12-dione, 10-[[2-O-(2-amino-2,6-dideoxy-3-O-methyl-.α.-D- galactopyranosyl)-6-deoxy-3-C-methyl-.β.-D- galactopyranosyl]oxy]-6-hydroxy-1-methyl
Synonym	More Synonyms

Density	1.57g/cm3
Boiling Point	913.2ºC at 760mmHg
Molecular Formula	C₃₃H₃₅NO₁₃
Molecular Weight	653.63000
Flash Point	506.1ºC
Exact Mass	653.21100
PSA	213.51000
LogP	2.42660
Index of Refraction	1.707
InChIKey	MGQRRMONVLMKJL-KWJIQSIXSA-N
SMILES	COC1C(N)C(OC2C(Oc3cccc4c(O)c5c(=O)oc6ccc(C)c7c(=O)oc(c34)c5c67)OC(C)C(O)C2(C)O)OC(C)C1O

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DE5410000

CHEMICAL NAME :: Benzo(h)(1)benzopyrano(5,4,3-cde)(1)benzopyran-5,12-d ione, 10-((2-O-(2-amino-2,6-dideoxy-3-O- methyl-alpha-D-galactopyranosyl)-6-deoxy-3-C-methyl-b eta-D-galactopyranosy l)oxy-6-hydroxy-1- methyl-

CAS REGISTRY NUMBER :: 97068-30-9

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C33-H35-N-O13

MOLECULAR WEIGHT :: 653.69

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 :: 38 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 39,784,1986

Precursor 0
DownStream 4
CAS#:106544-47-2 N-Acetylelsamicin A CAS#:34170-23-5 Chartarin CAS#:106544-49-4 (2R,3S,4S,5R,6R... CAS#:106544-50-7 (2R,3S,4S,5R,6S...

Name: Moderate liver toxicity, defined via clinical-chemistry results: ALT or AST serum act...
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL3137722

Name: Highest frequency of moderate liver toxicity observed during clinical trials, express...
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL3137723

Name: Acute liver toxicity defined via clinical observations and clear clinical-chemistry r...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3137724

Name: Highest frequency of acute liver toxicity observed during clinical trials, expressed ...
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL3137725

Name: Cytolytic liver toxicity, either proven histopathologically or where the ratio of max...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3137726

Name: Choleostatic liver toxicity, either proven histopathologically or where the ratio of ...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3137727

Name: Severe hepatitis, defined as possibly life-threatening liver failure or through clini...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3137728

Name: Chronic liver disease either proven histopathologically, or through a chonic elevatio...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3137729

Name: Cirrhosis, proven histopathologically. Value is number of references indexed. [column...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3137730

Name: Granulomatous liver disease, proven histopathologically. Value is number of reference...
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL3137731

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Elsamitrucin

E-87/025

elsamicin A

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Benzo[h][1]benzopyrano[5,4,3-cde][1]benzopyran-5,12-dione,10-[[2-O-(2-amino-2,6-dideoxy-3-O-methyl-a-D-galactopyranosyl)-6-deoxy-3-C-methyl-b-D-galactopyranosyl]oxy]-6-hydroxy-1-methyl

Names

Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Precursor & DownStream

Bioassay

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.