SJG 136
CAS Registry Number®
232931-57-6
CAS Name
SJG 136Molecular Formula
C31H32N4O6Molecular Mass
556.61Cite this Page
SJG 136. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=232931-57-6 (retrieved ) (CAS RN: 232931-57-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C31H32N4O6/c1-18-8-20-14-32-24-12-28(26(38-3)10-22(24)30(36)34(20)16-18)40-6-5-7-41-29-13-25-23(11-27(29)39-4)31(37)35-17-19(2)9-21(35)15-33-25/h10-15,20-21H,1-2,5-9,16-17H2,3-4H3/t20-,21-/m0/s1
InChIKey
InChIKey=RWZVMMQNDHPRQD-SFTDATJTSA-N
SMILES
O=C1C=2C(=CC(OCCCOC3=C(OC)C=C4C(=C3)N=C[C@]5(N(C4=O)CC(=C)C5)[H])=C(OC)C2)N=C[C@]6(N1CC(=C)C6)[H]
Canonical SMILES
O=C1C=2C=C(OC)C(OCCCOC3=CC=4N=CC5N(C(=O)C4C=C3OC)CC(=C)C5)=CC2N=CC6N1CC(=C)C6
Other Names for this Substance
- 5H-Pyrrolo[2,1-c][1,4]benzodiazepin-5-one, 8,8′-[1,3-propanediylbis(oxy)]bis[1,2,3,11a-tetrahydro-7-methoxy-2-methylene-, (11aS,11′aS)-
- (11aS,11′aS)-8,8′-[1,3-Propanediylbis(oxy)]bis[1,2,3,11a-tetrahydro-7-methoxy-2-methylene-5H-pyrrolo[2,1-c][1,4]benzodiazepin-5-one]
- SJG 136
- UP 2001
- NSC 694501