Caspofungin structure, CAS 162808-62-0

Caspofungin

CAS Number162808-62-0

SynonymsCaspofungin; m991; PORFUNGIN; POFUNGIN

Molecular FormulaC53H89N9O15

Molecular Weight1213.42

Purity

Density1.36g/cm3

Boiling Point1408.1ºC at 760mmHg

Melting Point

Flash Point

Appearance

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Symbol

Signal Word

Cat. No.: 2A-2181887 Purity:
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Quality Control of [ 162808-62-0 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number162808-62-0
Catalog No.2A-2181887
Chinese Name卡泊芬净
SynonymsCaspofungin; m991; PORFUNGIN; POFUNGIN
Molecular FormulaC53H89N9O15
Molecular Weight1213.42
Density1.36g/cm3
Boiling Point1408.1ºC at 760mmHg
Storage Condition2-8°C
ApplicationCaspofungin is an effective antifungal agent. Caspofungin inhibits the synthesis of β-(l,3)-D-glucan, a component of the fungal cell wall [1][2].
PubChem ID40654165
SMILESCCC(C)CC(C)CCCCCCCCC(=O)NC1CC(O)C(NCCN)NC(=O)C2C(O)CCN2C(=O)C(C(O)CCN)NC(=O)C(C(O)C(O)c2ccc(O)cc2)NC(=O)C2CC(O)CN2C(=O)C(C(C)O)NC1=O
InChIInChI=1S/C52H88N10O15/c1-5-28(2)24-29(3)12-10-8-6-7-9-11-13-39(69)56-34-26-38(68)46(55-22-21-54)60-50(75)43-37(67)19-23-61(43)52(77)41(36(66)18-20-53)58-49(74)42(45(71)44(70)31-14-16-32(64)17-15-31)59-48(73)35-25-33(65)27-62(35)51(76)40(30(4)63)57-47(34)72/h14-17,28-30,33-38,40-46,55,63-68,70-71H,5-13,18-27,53-54H2,1-4H3,(H,56,69)(H,57,72)(H,58,74)(H,59,73)(H,60,75)/t28?,29?,30-,33-,34+,35+,36-,37+,38-,40+,41+,42+,43+,44+,45+,46-/m1/s1
InChI KeyJYIKNQVWKBUSNH-FMIIYRCSSA-N
Transport InfoProduct name: Caspofungin
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