id | C00005647 |
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Name | Patuletin-3-rutinoside / Patuletin 3-O-rutinoside |
CAS RN | 19833-26-2 |
Standard InChI | InChI=1S/C28H32O17/c1-8-16(32)20(36)22(38)27(42-8)41-7-14-17(33)21(37)23(39)28(44-14)45-26-19(35)15-13(6-12(31)25(40-2)18(15)34)43-24(26)9-3-4-10(29)11(30)5-9/h3-6,8,14,16-17,20-23,27-34,36-39H,7H2,1-2H3/t8?,14?,16-,17+,20-,21?,22?,23?,27+,28-/m0/s1 |
Standard InChI (Main Layer) | InChI=1S/C28H32O17/c1-8-16(32)20(36)22(38)27(42-8)41-7-14-17(33)21(37)23(39)28(44-14)45-26-19(35)15-13(6-12(31)25(40-2)18(15)34)43-24(26)9-3-4-10(29)11(30)5-9/h3-6,8,14,16-17,20-23,27-34,36-39H,7H2,1-2H3 |
Phytochemical cluster | No. 15 |
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KCF-S cluster | No. 1 |
By standard InChI | |
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By standard InChI Main Layer | CHEMBL442920 CHEMBL2037043 |
By LinkDB |
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By CAS RN |
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class name | count |
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asterids | 5 |
Liliopsida | 2 |
family name | count |
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Asteraceae | 5 |
Eriocaulaceae | 2 |