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Substance Name: Azadirachtin I
RN: 134788-16-2
InChIKey: DTVGLMFEPSBEIA-JPALLTBASA-N

Molecular Formula

  • C32-H42-O12

Molecular Weight

  • 618.672
 
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Names and Synonyms

  • Azadirachtin I

Registry Numbers

CAS Registry Number

  • 134788-16-2

System Generated Number

  • 0134788162

Structure Descriptors

InChI

1S/C32H42O12/c1-7-14(2)24(35)42-18-11-17(41-15(3)33)27(4)12-39-20-21(27)30(18)13-40-25(36)22(30)28(5,23(20)34)32-19-10-16(29(32,6)44-32)31(37)8-9-38-26(31)43-19/h7-9,16-23,25-26,34,36-37H,10-13H2,1-6H3/b14-7+/t16-,17+,18-,19?,20+,21-,22-,23+,25+,26-,27+,28-,29-,30?,31-,32-/m0/s1

InChIKey

DTVGLMFEPSBEIA-JPALLTBASA-N

Smiles

O1[C@H]2[C@](O)(C=CO2)[C@@H]2[C@@]3(O[C@]3([C@@]3([C@@H]([C@H]4[C@H]5[C@]([C@@H](C[C@@H]([C@@]65[C@H]3[C@H](O)OC6)OC(\C(C)=C\C)=O)OC(C)=O)(C)CO4)O)C)[C@@H]1C2)C