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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

gitoformate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C46H64O19

inchi

  • InChI=1S/C46H64O19/c1-24-41(59-23-51)32(55-19-47)14-38(60-24)64-43-26(3)62-39(16-34(43)57-21-49)65-42-25(2)61-37(15-33(42)56-20-48)63-29-8-10-44(4)28(13-29)6-7-31-30(44)9-11-45(5)40(27-12-36(52)54-18-27)35(58-22-50)17-46(31,45)53/h12,19-26,28-35,37-43,53H,6-11,13-18H2,1-5H3/t24-,25-,26+,28-,29+,30+,31-,32+,33+,34-,35+,37+,38+,39-,40+,41-,42-,43+,44+,45-,46+/m1/s1

inchikey

  • DOMHWKQEPDYUQX-QDMRMOHQSA-N

mass

  • 920.991

monoisotopicmass

  • 920.40418

smiles

  • O[C@@]12[C@@](C)([C@H]([C@H](C1)OC=O)C3=CC(OC3)=O)CC[C@]4([C@]2(CC[C@]5([C@]4(C)CC[C@@H](C5)O[C@H]6C[C@H](OC=O)[C@@H]([C@H](O6)C)O[C@@H]7C[C@@H](OC=O)[C@H]([C@@H](O7)C)O[C@H]8C[C@H](OC=O)[C@@H]([C@H](O8)C)OC=O)[H])[H])[H]

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:135896

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