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Ignavine
[CAS# 1357-76-2]

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CAS#: 1357-76-2
Product: Ignavine
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Identification
Name Ignavine
Synonyms Hetisan-2,13,9,15-Tetrol, 2-Benzoate, (2-Alpha,3-Beta,15-Beta)-; Ignavine
Molecular Structure CAS#: 1357-76-2, Ignavine
Molecular Formula C27H31NO5
Molecular Weight 449.55
CAS Registry Number 1357-76-2
SMILES [C@]23(O)C15C[C@H]([C@@H]([C@@]7([C@H]1[C@H]6CC24[C@@H](C([C@H](C3)CC4C5N6C7)=C)O)C)O)OC(C8=CC=CC=C8)=O
InChI 1S/C27H31NO5/c1-13-15-8-16-20-26-11-18(33-23(31)14-6-4-3-5-7-14)22(30)24(2)12-28(20)17(19(24)26)10-25(16,21(13)29)27(26,32)9-15/h3-7,15-22,29-30,32H,1,8-12H2,2H3/t15-,16?,17+,18+,19+,20?,21+,22-,24-,25?,26?,27-/m0/s1
InChIKey FOIZZXKAYVIZQC-HBFXMWHYSA-N
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