Milbemycin beta3
chemical compound
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Milbemycin beta3
Summary
Milbemycin beta3 is a group of stereoisomers[1].
Key Facts
- Milbemycin beta3's instance of is recorded as group of stereoisomers[2].
- Milbemycin beta3's CAS Registry Number is recorded as 56198-39-1[3].
- Milbemycin beta3's canonical SMILES is recorded as O=C1OC2CC(OC3(OC(C)C(C)CC3)C2)CC=C(C)CC(C=CC=C(C=4C=C(O)C(=CC14)C)C)C[4].
- Milbemycin beta3's InChI is recorded as InChI=1S/C31H42O5/c1-19-8-7-9-22(4)27-17-29(32)23(5)15-28(27)30(33)34-26-16-25(11-10-20(2)14-19)36-31(18-26)13-12-21(3)24(6)35-31/h7-10,15,17,19,21,24-26,32H,11-14,16,18H2,1-6H3/b8-7+,20-10+,22-9+/t19-,21-,24+,25+,26?,31-/m0/s1[5].
- Milbemycin beta3's InChIKey is recorded as PPMBESPRWFQXDF-KEMGXVBCSA-N[6].
- Milbemycin beta3's chemical formula is recorded as C₃₁H₄₂O₅[7].
- Milbemycin beta3's subclass of is recorded as macrolides[8].
- Milbemycin beta3's PubChem CID is recorded as 71300428[9].
- Milbemycin beta3's ChEBI ID is recorded as 209386[10].
- Milbemycin beta3's isomeric SMILES is recorded as C/C1=C\C[C@@H]2CC(C[C@]3(CCC@HC@@HO3)O2)OC(=O)c2cc(C)c(O)cc2/C(C)=C/C=C/C@HC1C@HC@@HO3)O2)OC(=O)c2cc(C)c(O)cc2/C(C)=C/C=C/C@HC1">[11].
- Milbemycin beta3's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+494.30322444399997'}[12].
- Milbemycin beta3's SureChEMBL ID is recorded as 30526371[13].
- Milbemycin beta3's DSSTox substance ID is recorded as DTXSID30204736[14].
- Milbemycin beta3's Natural Product Atlas ID is recorded as NPA018362[15].
- Milbemycin beta3's DSSTOX compound identifier is recorded as DTXCID60127227[16].
- Milbemycin beta3's UniChem compound ID is recorded as 65931460[17].