116276-03-0

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Basic information

Product Name: Pradimicinone
Synonyms: Benanomicinone;BMY-28750;N-[[(5S)-1,5α,6β,9,14-Pentahydroxy-3-methyl-8,13-dioxo-11-methoxy-5,6,8,13-tetrahydrobenzo[a]naphthacene-2-yl]carbonyl]-D-alanine;N-[[[(5S)-5,6,8,13-Tetrahydro-1,5α,6β,9,14-pentahydroxy-11-methoxy-3-methyl-8,13-dioxobenzo[a]naphthacen]-2-yl]carbonyl]-D-alanine;Pradimicinone;Pradimicinone I
CAS NO:116276-03-0
Molecular Formula: C₂₈H₂₃NO₁₁
Molecular Weight: 549.48232
EINECS: N/A
Product Categories: N/A
Mol File: 116276-03-0.mol
Article Data: 2

Chemical Properties

Melting Point: N/A
Boiling Point: 903.2°C at 760 mmHg
Flash Point: 500.1°C
Appearance: /
Density: 1.647g/cm³
Vapor Pressure: 3.86E-35mmHg at 25°C
Refractive Index: 1.747
Storage Temp.: N/A
Solubility: N/A
CAS DataBase Reference: Pradimicinone(CAS DataBase Reference)
NIST Chemistry Reference: Pradimicinone(116276-03-0)
EPA Substance Registry System: Pradimicinone(116276-03-0)

Safety Data

Hazard Codes: N/A
Statements: N/A
Safety Statements: N/A
WGK Germany:
RTECS:
HazardClass: N/A
PackingGroup: N/A
Hazardous Substances Data: 116276-03-0(Hazardous Substances Data)

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Check Digit Verification of cas no

The CAS Registry Mumber 116276-03-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,6,2,7 and 6 respectively; the second part has 2 digits, 0 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 116276-03:
(8*1)+(7*1)+(6*6)+(5*2)+(4*7)+(3*6)+(2*0)+(1*3)=110
110 % 10 = 0
So 116276-03-0 is a valid CAS Registry Number.

InChI:InChI=1/C28H23NO11/c1-8-4-11-18(25(35)16(8)27(37)29-9(2)28(38)39)19-13(24(34)23(11)33)7-14-20(26(19)36)22(32)12-5-10(40-3)6-15(30)17(12)21(14)31/h4-7,9,23-24,30,33-36H,1-3H3,(H,29,37)(H,38,39)/t9-,23+,24+/m1/s1

116276-03-0SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name	(2R)-2-[[(5S,6S)-1,5,6,9,14-pentahydroxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carbonyl]amino]propanoic acid

1.2 Other means of identification

Product number	-
Other names	PMNI

1.3 Recommended use of the chemical and restrictions on use

Identified uses	For industry use only.
Uses advised against	no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number	-
Service hours	Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

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116276-03-0Relevant articles and documents

Total synthesis of pradimicinone, the common aglycon of the pradimicin-benanomicin antibiotics

Kitamura, Mitsuru,Ohmori, Ken,Kawase, Toshihisa,Suzuki, Keisuke

, p. 1229 - 1232 (2007/10/03)

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