CAS No.37332-99-3,Avoparcin Suppliers

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Basic Information

Molecular Structure:
CAS No.:	37332-99-3
Name:	Avoparcin

Formula:	C₈₉H₁₀₂ClN₉O₃₆
Molecular Weight:	1909.26
Synonyms:	Avotan;Avotan 50;AV-290;Avoparcina [INN-Spanish];Avoparcine;LL-AV290;
EINECS:	253-466-4
PSA:	631.26000
LogP:	3.47230

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Specification

The Avoparcin, with the CAS registry number 37332-99-3, is also known as Avoparcina. Its EINECS number is 253-466-4. This chemical's molecular formula is C₈₉H₁₀₂ClN₉O₃₆ and molecular weight is 1909.26. What's more, its systematic name is also Avoparcin. Its classification codes are: (1)Antibacterial; (2)Drug / Therapeutic Agent.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C83H92ClN9O31/c1-30-64(99)46(85)27-54(115-30)122-72-37-12-20-50(45(84)22-37)120-52-24-38-23-51(73(52)124-83-74(70(105)68(103)53(29-94)121-83)123-55-28-47(86)65(100)31(2)116-55)118-41-17-9-35(10-18-41)67(102)62(92-75(107)57(87-4)33-7-15-42(16-8-33)119-82-71(106)69(104)66(101)32(3)117-82)79(111)88-58(34-5-13-39(95)14-6-34)76(108)90-60(38)78(110)89-59-36-11-19-48(97)43(21-36)56-44(25-40(96)26-49(56)98)61(81(113)114)91-80(112)63(72)93-77(59)109/h5-26,30-32,46-47,53-55,57-72,74,82-83,87,94-106H,27-29,85-86H2,1-4H3,(H,88,111)(H,89,110)(H,90,108)(H,91,112)(H,92,107)(H,93,109)(H,113,114)/t30-,31-,32-,46+,47+,53+,54-,55-,57+,58-,59+,60+,61-,62+,63-,64-,65-,66-,67+,68+,69+,70-,71+,72+,74?,82-,83-/m0/s1
(2)Smiles: CN[C@@H](C(=O)N[C@@H]1[C@H](O)c2ccc(Oc3cc4cc(c3O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O[C@H]3C[C@@H](N)[C@@H](O)[C@@H](C)O3)Oc3c(Cl)cc(cc3)[C@@H](O[C@H]3C[C@@H](N)[C@@H](O)[C@@H](C)O3)[C@@H]3NC(=O)[C@H](NC(=O)[C@@H]4NC(=O)[C@@H](NC1=O)c1ccc(O)cc1)c1cc(c(O)cc1)c1c(cc(O)cc1O)[C@H](NC3=O)C(O)=O)cc2)c1ccc(O[C@@H]2O[C@@H](C)[C@H](O)[C@H](O)[C@H]2O)cc1

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
chicken	LD50	oral	> 10gm/kg (10000mg/kg)	Merck Index. Vol. 11, Pg. 141, 1989.
mouse	LD50	oral	> 10gm/kg (10000mg/kg)	Merck Index. Vol. 11, Pg. 141, 1989.
rat	LD50	oral	> 10gm/kg (10000mg/kg)	Merck Index. Vol. 11, Pg. 141, 1989.