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Ivermectin B1 Aglycon

ISO 17034:
Catalog Number : CS-T-56936
CAS Number : 73162-95-5
Status : Available for immediate dispatch
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Chemical Information

Chemical Name : Ivermectin B1 Aglycon
Category : Impurity Standards
Synonyms : Not available
Molecular Weight : 586.76 mol/g
Molecular Formula : C₃₄H₅₀O₈

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Hazardous Compound : No

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Additional Information


Canonical SMILES : CCC(C)C1C(CCC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)O)C)C
Isomeric SMILES : CC[C@H](C)[C@@H]1[C@H](CC[C@@]2(O1)C[C@@H]3C[C@H](O2)C/C=C(\[C@H]([C@H](/C=C\C=C4CO[C@H]5[C@@]4([C@@H](C=C([C@H]5O)C)C(=O)O3)O)C)O)/C)C
InChI : InChI=1S/C34H50O8/c1-7-19(2)30-22(5)13-14-33(42-30)17-26-16-25(41-33)12-11-21(4)28(35)20(3)9-8-10-24-18-39-31-29(36)23(6)15-27(32(37)40-26)34(24,31)38/h8-11,15,19-20,22,25-31,35-36,38H,7,12-14,16-18H2,1-6H3/b9-8-,21-11-,24-10?/t19-,20-,22-,25+,26-,27-,28-,29+,30+,31+,33+,34+/m0/s1
InchIKey : XOCXXEYUGYTCNG-AFVSOJIRSA-N
IUPAC Name : (1R,4S,5'S,6R,6'R,8R,10Z,12S,13S,14Z,20R,21R,24S)-6'-[(2S)-butan-2-yl]-12,21,24-trihydroxy-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one
Exact Mass : 586.35056855