NSC126812

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Creator
US National Cancer Institute
Publication Date
2005-09-05
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
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Citation
Unknown author (2005). NSC126812. [chemical structure]. http://www.dspace.cam.ac.uk/handle/1810/101338
Identifiers
NSC126812
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/101338
IUPAC Chemical Identifier (IChI): C40H50O4,1H3-26(16H-17H-31(29-12H-8H-6H-9H-13H-29)30-14H-10H-7H-11H-15H-30)34H-19H2-21H2-36H-35H-20H2-18H2-32H-24H2-33H(43-27(2H3)41)22H2-23H2-39(32,4H3)37H(35)25H2-38H(40(34,36)5H3)44-28(3H3)42
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C40H50O4/c1-26(16-18-33(29-12-8-6-9-13-29)30-14-10-7-11-15-30)35-20-21-36-34-19-17-31-24-32(43-27(2)41)22-23-39(31,4)37(34)25-38(40(35,36)5)44-28(3)42/h6-16,18,31-32,34-38H,17,19-25H2,1-5H3/b26-16+/t31-,32-,34-,35+,36-,37-,38+,39-,40+/m0/s1
IUPAC/NIST Chemical Identifier Key (INChI): MXSSSAFMPHSRQJ-BSLPQTKVSA-N