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ZOTAROLIMUS structure, CAS 221877-54-9

ZOTAROLIMUS

CAS Number221877-54-9

SynonymsZotarolimus; ABT-578

Molecular FormulaC52H79N5O12

Molecular Weight966.21

Purity

Density1.3±0.1 g/cm3

Boiling Point1016.2±75.0 °C at 760 mmHg

Melting Point100-105°C

Flash Point

Appearancepowder

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-3180611 Purity:
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Quality Control of [ 221877-54-9 ] SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number221877-54-9
Catalog No.2A-3180611
Chinese Name佐他莫司(ABT-578)
SynonymsZotarolimus; ABT-578
Molecular FormulaC52H79N5O12
Molecular Weight966.21
Density1.3±0.1 g/cm3
Boiling Point1016.2±75.0 °C at 760 mmHg
Melting Point100-105°C
Appearancepowder
Storage ConditionHygroscopic, -20°C Freezer, Under Inert Atmosphere
ApplicationZotarolimus is a rapamycin analogue.
HTC29349990
PubChem ID14841277
MDL NumberMFCD09752954
SMILESCOC1CC2CCC(C)C(O)(O2)C(=O)C(=O)N2CCCCC2C(=O)OC(C(C)CC2CCC(n3cnnn3)C(OC)C2)CC(=O)C(C)C=C(C)C(O)C(OC)C(=O)C(C)CC(C)C=CC=CC=C1C
InChIInChI=1S/C52H79N5O12/c1-31-16-12-11-13-17-32(2)43(65-8)28-39-21-19-37(7)52(64,69-39)49(61)50(62)56-23-15-14-18-41(56)51(63)68-44(34(4)26-38-20-22-40(45(27-38)66-9)57-30-53-54-55-57)29-42(58)33(3)25-36(6)47(60)48(67-10)46(59)35(5)24-31/h11-13,16-17,25,30-31,33-35,37-41,43-45,47-48,60,64H,14-15,18-24,26-29H2,1-10H3/b13-11+,16-12+,32-17+,36-25+/t31-,33-,34-,35-,37-,38+,39+,40+,41+,43+,44+,45-,47-,48+,52-/m1/s1
InChI KeyCGTADGCBEXYWNE-VNODUHINSA-N
NACRES CodeNA.77
UNSPSC51111800
Transport InfoProduct Name: Zotarolimus
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