NSC137054
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Creator
US National Cancer Institute
Publication Date
2006-01-12Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
Show full item recordIdentifiers
NSC137054
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/108044
IUPAC Chemical Identifier (IChI): C108H180O7P2,1H3-73H(2H3)33H2-29H2-37H2-77H(9H3)89H-41H2-45H2-97H-85H-25H2-21H-69-65H2-81H(49H2-57H2-101(69,13H3)93H(85)53H2-61H2-105(89,97)17H3)111-116(109,112-82H-50H2-58H2-102(14H3)70(66H2-82)22H-26H2-86H-94H(102)54H2-62H2-106(18H3)90H(42H2-46H2-98H(86)106)78H(10H3)38H2-30H2-34H2-74H(3H3)4H3)115-117(110,113-83H-51H2-59H2-103(15H3)71(67H2-83)23H-27H2-87H-95H(103)55H2-63H2-107(19H3)91H(43H2-47H2-99H(87)107)79H(11H3)39H2-31H2-35H2-75H(5H3)6H3)114-84H-52H2-60H2-104(16H3)72(68H2-84)24H-28H2-88H-96H(104)56H2-64H2-108(20H3)92H(44H2-48H2-100H(88)108)80H(12H3)40H2-32H2-36H2-76H(7H3)8H3
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C108H180O7P2/c1-69(2)25-21-29-73(9)89-41-45-93-85-37-33-77-65-81(49-57-101(77,13)97(85)53-61-105(89,93)17)111-116(109,112-82-50-58-102(14)78(66-82)34-38-86-94-46-42-90(74(10)30-22-26-70(3)4)106(94,18)62-54-98(86)102)115-117(110,113-83-51-59-103(15)79(67-83)35-39-87-95-47-43-91(75(11)31-23-27-71(5)6)107(95,19)63-55-99(87)103)114-84-52-60-104(16)80(68-84)36-40-88-96-48-44-92(76(12)32-24-28-72(7)8)108(96,20)64-56-100(88)104/h33-36,69-76,81-100H,21-32,37-68H2,1-20H3/t73-,74+,75-,76+,81-,82-,83+,84-,85-,86-,87-,88+,89-,90-,91+,92+,93-,94-,95-,96-,97-,98-,99-,100+,101-,102+,103-,104+,105+,106+,107+,108+,116-,117-/m0/s1
IUPAC/NIST Chemical Identifier Key (INChI): GZGBKAXVKDZKOJ-LVWDIUDXSA-N