id | C00040653 |
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Name | Withangulatin B / (+)-Withangulatin B |
CAS RN | 946074-78-8 |
Standard InChI | InChI=1S/C28H38O9/c1-13-10-20(36-22(32)14(13)2)25(5,33)26(34)12-19(31)27(35)16-11-21-28(37-21)18(30)7-6-17(29)24(28,4)15(16)8-9-23(26,27)3/h6-7,15-16,18-21,30-31,33-35H,8-12H2,1-5H3/t15-,16+,18-,19-,20+,21+,23+,24-,25+,26-,27-,28+/m0/s1 |
Standard InChI (Main Layer) | InChI=1S/C28H38O9/c1-13-10-20(36-22(32)14(13)2)25(5,33)26(34)12-19(31)27(35)16-11-21-28(37-21)18(30)7-6-17(29)24(28,4)15(16)8-9-23(26,27)3/h6-7,15-16,18-21,30-31,33-35H,8-12H2,1-5H3 |
Phytochemical cluster | No. 58 |
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KCF-S cluster | No. 176 |
By standard InChI | |
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By standard InChI Main Layer | CHEMBL390851 |
By LinkDB |
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By CAS RN |
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class name | count |
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asterids | 1 |
family name | count |
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Solanaceae | 1 |
KNApSAcK organism | *ID | *family | *plant class | *kingdom |
---|---|---|---|---|
Physalis angulata | 113208 | Solanaceae | asterids | Viridiplantae |