Cas no 169397-89-1 (3a,3'a(1H,1'H):7',3''a(1''H)-Terpyrrolo[2,3-b]indole, 2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1'',8,8''-pentamethyl-, (3aS,3'aS,3''aR,8aR,8'aS,8''aR)-)
![3a,3'a(1H,1'H):7',3''a(1''H)-Terpyrrolo[2,3-b]indole, 2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1'',8,8''-pentamethyl-, (3aS,3'aS,3''aR,8aR,8'aS,8''aR)- structure](https://ossimg.kuujia.com/scimg/169500/169397-89-1x500.png)
169397-89-1 structure
Product Name:3a,3'a(1H,1'H):7',3''a(1''H)-Terpyrrolo[2,3-b]indole, 2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1'',8,8''-pentamethyl-, (3aS,3'aS,3''aR,8aR,8'aS,8''aR)-
CAS No:169397-89-1
MF:C35H42N6
MW:546.748187541962
CID:159630
Update Time:2024-03-01
3a,3'a(1H,1'H):7',3''a(1''H)-Terpyrrolo[2,3-b]indole, 2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1'',8,8''-pentamethyl-, (3aS,3'aS,3''aR,8aR,8'aS,8''aR)- Chemical and Physical Properties
Names and Identifiers
-
- 3a,3'a(1H,1'H):7',3''a(1''H)-Terpyrrolo[2,3-b]indole,2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1'',8,8''-pentamethyl-,(3aS,3'aS,3''aR,8aR,8'aS,8''aR)-
- 3a,3'a(1H,1'H):7',3''a(1''H)-Terpyrrolo[2,3-b]indole,2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1'',8,8''-pentam
- (-)-Idiospermuline
- Calycanthidine,8'-(2,3,8,8a-tetrahydro-1,8-dimethylpyrrolo[2,3-b]indol-3a(1H)-yl)-, [2b,2'b,3a,3'a,8'(3aR,8aR)]-
- Idiospermuline
- 3a,3'a(1H,1'H):7',3''a(1''H)-Terpyrrolo[2,3-b]indole, 2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1'',8,8''-pentamethyl-, (3aS,3'aS,3''aR,8aR,8'aS,8''aR)-
-
- Inchi： 1S/C35H42N6/c1-37-21-18-34(35-19-22-39(3)32(35)41(5)28-16-9-7-12-24(28)35)26-14-10-13-25(29(26)36-30(34)37)33-17-20-38(2)31(33)40(4)27-15-8-6-11-23(27)33/h6-16,30-32,36H,17-22H2,1-5H3
- InChI Key： DLRDWTSPLDTPEG-UHFFFAOYSA-N
- SMILES： CN1C2NC3C(C45C6C(=CC=CC=6)N(C)C4N(C)CC5)=CC=CC=3C2(C23C4C(=CC=CC=4)N(C)C2N(C)CC3)CC1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 41
- XLogP3: 3.084
3a,3'a(1H,1'H):7',3''a(1''H)-Terpyrrolo[2,3-b]indole, 2,2',2'',3,3',3'',8,8',8'',8a,8'a,8''a-dodecahydro-1,1',1'',8,8''-pentamethyl-, (3aS,3'aS,3''aR,8aR,8'aS,8''aR)- Related Literature
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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