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Catalog Number | ACM639305 |
CAS Number | 639-30-5 |
Structure | ![]() |
Synonyms | 21α-Hydroxyajmalan-17-one |
Molecular Weight | 324.4 |
InChI | InChI=1S/C20H24N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-17,19,24H,3,8-9H2,1-2H3/t10-,11-,14-,15-,16,17-,19+,20+/m0/s1 |
InChI Key | JLUFXYAXVHAFTF-YNSIMGNASA-N |
Purity | 95%+ |
Complexity | 608 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 7 |
Exact Mass | 324.183778013 |
Heavy Atom Count | 24 |
Hydrogen Bond Acceptor Count | 4 |
Hydrogen Bond Donor Count | 1 |
Isomeric SMILES | CC[C@H]1[C@@H]2C[C@H]3[C@H]4[C@@]5(C[C@@H](C2C5=O)N3[C@@H]1O)C6=CC=CC=C6N4C |
Monoisotopic Mass | 324.183778013 |
PhysicalState | Powder |
Rotatable Bond Count | 1 |
Topological Polar Surface Area | 43.8 Ų |
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