Deoxymulundocandin structure, CAS 138626-63-8

Deoxymulundocandin

CAS Number138626-63-8

SynonymsExact Mass 991.54800; PSA 365.41000; Index of Refraction 1.618; InChIKey GWBOEEVOSDBARW-UHFFFAOYSA-N; Synonyms

Molecular FormulaC48H77N7O15

Molecular Weight992.16300

Purity

Density1.36g/cm3

Boiling Point1330.3ºC at 760mmHg

Melting Point

Flash Point

Appearance

EINECS

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Symbol

Signal Word

Cat. No.: 2A-2188229 Purity:
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Quality Control of [ 138626-63-8 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number138626-63-8
Catalog No.2A-2188229
Chinese NameDeoxymulundocandin
SynonymsExact Mass 991.54800; PSA 365.41000; Index of Refraction 1.618; InChIKey GWBOEEVOSDBARW-UHFFFAOYSA-N; Synonyms
Molecular FormulaC48H77N7O15
Molecular Weight992.16300
Density1.36g/cm3
Boiling Point1330.3ºC at 760mmHg
PubChem ID14841342
SMILESCCC(C)CCCCCCCCCCC(=O)NC1CC(O)C(O)NC(=O)C2C(O)C(C)CN2C(=O)C(CO)NC(=O)C(C(O)Cc2ccc(O)cc2)NC(=O)C2CC(O)CN2C(=O)C(C(C)O)NC1=O
InChIInChI=1S/C48H77N7O15/c1-5-26(2)14-12-10-8-6-7-9-11-13-15-37(62)49-32-22-36(61)44(66)53-46(68)40-41(63)27(3)23-55(40)47(69)33(25-56)50-45(67)39(35(60)20-29-16-18-30(58)19-17-29)52-43(65)34-21-31(59)24-54(34)48(70)38(28(4)57)51-42(32)64/h16-19,26-28,31-36,38-41,44,56-61,63,66H,5-15,20-25H2,1-4H3,(H,49,62)(H,50,67)(H,51,64)(H,52,65)(H,53,68)
InChI KeyGWBOEEVOSDBARW-UHFFFAOYSA-N
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