Sebastianine B structure

Sebastianine B

(14R,16R)-14-hydroxy-16-propan-2-yl-15-oxa-2,12,18-triazahexacyclo[11.8.1.114,18.03,8.09,22.021,23]tricosa-1,3,5,7,9(22),10,12,21(23)-octaen-17-one

Also Known As: Sebastianine B|J1.788.174D|(14R)-8-Hydroxy-14-isopropyl-8,9,10,11-tetrahydro-8alpha,9-(epoxyethano)-7,9,12-triazabenzo[de]cyclopenta[a]anthracene-13-one|(14R,16R)-14-hydroxy-16-(propan-2-yl)-15-oxa-2,12,18-triazahexacyclo[11.8.1.114,18.03,8.09,22.021,23]tricosa-1,3,5,7,9,11,13(22),21(23)-octaen-17-one|(14R,16R)-14-hydroxy-16-propan-2-yl-15-oxa-2,12,18-triazahexacyclo(11.8.1.114,18.03,8.09,22.021,23)tricosa-1,3,5,7,9(22),10,12,21(23)-octaen-17-one|(14R,16R)-14-Hydroxy-16-propan-2-yl-15-oxa-2,12,18-triazahexacyclo[11.8.1.114,18.03,8.09,22.021,23]tricosa-1,3,5,7,9(22),10,12,21(23)-octaen-17-one

CAS: 448264-65-1
Molecular Formula C22H19N3O3
Molecular Weight 373.14264 g/mol
LogP 2.9399
Topological Polar Surface Area 75.55 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 1
Exact Mass 373.14264
Monoisotopic Mass 373.14264
Heavy Atoms 28
Complexity 1232.402

Chemical Identifiers

CAS Number 448264-65-1
SMILES CC(C)[C@@H]1C(=O)N2CCC3=C2[C@@](O1)(C4=NC=CC5=C4C3=NC6=CC=CC=C56)O

Product Overview

Sebastianine B (CAS 448264-65-1), with molecular formula C22H19N3O3 and molecular weight 373.14264 g/mol. IUPAC: (14R,16R)-14-hydroxy-16-propan-2-yl-15-oxa-2,12,18-triazahexacyclo[11.8.1.114,18.03,8.09,22.021,23]tricosa-1,3,5,7,9(22),10,12,21(23)-octaen-17-one.

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