TRISARUBICINOL

TRISARUBICINOL

Name: TRISARUBICINOL

CAS: 80470-08-2

Formula: C40 H51 N O15

Weight: 785.835

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Name: TRISARUBICINOL
CAS: 80470-08-2
Synonyms: TRISARUBICINOL
MDL.: MFCD01713101
H bond acceptor: 16
H bond donor: 6
Smile: C[C@H]1[C@H]([C@H](C[C@@H](O1)OC2CC(Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)O)O)(C(C)O)O)N(C)C)O[C@H]6C[C@@H]([C@@H]([C@@H](O6)C)O[C@H]7CCC(=O)[C@@H](O7)C)O
InChi: InChI=1S/C40H51NO15/c1-16-23(43)10-11-27(51-16)55-39-18(3)53-29(13-25(39)45)56-38-17(2)52-28(12-22(38)41(5)6)54-26-15-40(50,19(4)42)14-21-31(26)37(49)33-32(35(21)47)34(46)20-8-7-9-24(44)30(20)36(33)48/h7-9,16-19,22,25-29,38-39,42,44-45,47,49-50H,10-15H2,1-6H3/t16-,17-,18-,19?,22-,25-,26?,27-,28-,29-,38+,39+,40?/m0/s1
InChiKey: InChIKey=RFRIIINGCQOYCL-WLPDFNTPSA-N