Fagopyrine
CAS Registry Number®
72393-03-4
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CAS Name
FagopyrineMolecular Formula
C40H34N2O8Molecular Mass
670.71Cite this Page
Fagopyrine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=72393-03-4 (retrieved ) (CAS RN: 72393-03-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C40H34N2O8/c1-13-11-17(43)23-25-19(13)20-14(2)12-18(44)24-26(20)28-27(25)29-31(35(45)21(15-7-3-5-9-41-15)37(47)33(29)39(23)49)32-30(28)34(40(24)50)38(48)22(36(32)46)16-8-4-6-10-42-16/h11-12,15-16,41-48H,3-10H2,1-2H3
InChIKey
InChIKey=ROFJUMITFMRBRF-UHFFFAOYSA-N
SMILES
OC1=C2C=3C4=C5C=6C2=C(O)C(=C(O)C6C(=O)C7=C5C(C=8C4=C(C(=O)C3C(O)=C1C9CCCCN9)C(O)=CC8C)=C(C)C=C7O)C%10CCCCN%10
Canonical SMILES
O=C1C2=C(O)C=C(C=3C2=C4C=5C1=C(O)C(=C(O)C5C=6C(O)=C(C(O)=C7C(=O)C8=C(O)C=C(C3C8=C4C76)C)C9NCCCC9)C%10NCCCC%10)C
Other Names for this Substance
- Phenanthro[1,10,9,8-opqra]perylene-7,14-dione, 1,3,4,6,8,13-hexahydroxy-10,11-dimethyl-2,5-di-2-piperidinyl-
- 1,3,4,6,8,13-Hexahydroxy-10,11-dimethyl-2,5-di-2-piperidinylphenanthro[1,10,9,8-opqra]perylene-7,14-dione
- Fagopyrine
