Cas no 103590-56-3 (22a,23b-Epoxy-2H,11H,14H,22aH,23H,23bH-bisoxireno[6,7]indolizino[1,8-fg:1',8'-f'g'][1,5]diazocino[3,2,1-jk:7,6,5-j'k']dicarbazole,12a,24a-diethyl-1a,3a,4,5,11a,12,12a,12b,13a,15a,16,17,23a,24,24a,24b-hexadecahydro-,(1aR,3aS,5aR,11aS,12aS,12bS,13aR,15aS,17aR,22aR,23aS,23bR,24aS,24bS)- (9CI))
![22a,23b-Epoxy-2H,11H,14H,22aH,23H,23bH-bisoxireno[6,7]indolizino[1,8-fg:1',8'-f'g'][1,5]diazocino[3,2,1-jk:7,6,5-j'k']dicarbazole,12a,24a-diethyl-1a,3a,4,5,11a,12,12a,12b,13a,15a,16,17,23a,24,24a,24b-hexadecahydro-,(1aR,3aS,5aR,11aS,12aS,12bS,13aR,15aS,17aR,22aR,23aS,23bR,24aS,24bS)- (9CI) structure](https://ossimg.kuujia.com/scimg/104000/103590-56-3x500.png)
103590-56-3 structure
Product Name:22a,23b-Epoxy-2H,11H,14H,22aH,23H,23bH-bisoxireno[6,7]indolizino[1,8-fg:1',8'-f'g'][1,5]diazocino[3,2,1-jk:7,6,5-j'k']dicarbazole,12a,24a-diethyl-1a,3a,4,5,11a,12,12a,12b,13a,15a,16,17,23a,24,24a,24b-hexadecahydro-,(1aR,3aS,5aR,11aS,12aS,12bS,13aR,15aS,17aR,22aR,23aS,23bR,24aS,24bS)- (9CI)
CAS No:103590-56-3
MF:C40H46N4O3
MW:630.818250179291
CID:182235
PubChem ID:190556
Update Time:2025-04-19
22a,23b-Epoxy-2H,11H,14H,22aH,23H,23bH-bisoxireno[6,7]indolizino[1,8-fg:1',8'-f'g'][1,5]diazocino[3,2,1-jk:7,6,5-j'k']dicarbazole,12a,24a-diethyl-1a,3a,4,5,11a,12,12a,12b,13a,15a,16,17,23a,24,24a,24b-hexadecahydro-,(1aR,3aS,5aR,11aS,12aS,12bS,13aR,15aS,17aR,22aR,23aS,23bR,24aS,24bS)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 22a,23b-Epoxy-2H,11H,14H,22aH,23H,23bH-bisoxireno[6,7]indolizino[1,8-fg:1',8'-f'g'][1,5]diazocino[3,2,1-jk:7,6,5-j'k']dicarbazole,12a,24a-diethyl-1a,3a,4,5,11a,12,12a,12b,13a,15a,16,17,23a,24,24a,24b-hexadecahydro-,(1aR,3aS,5aR,11aS,12aS,12bS,13aR,15aS,17aR,22aR,23aS,23bR,24aS,24bS)- (9CI)
- 22a,23b-Epoxy-2H,11H,14H,22aH,23H,23bH-bisoxireno[6,7]indolizino[1,8-fg:1',8'-f'g'][1,5]diazocino[3,2,1-jk:7,6,5-j'k']dicarba
- 103590-56-3
- Hazuntiphylline
-
- Inchi： 1S/C40H46N4O3/c1-3-35-17-23-19-43-28-12-8-6-10-26(28)38-14-16-42-22-30-32(46-30)36(4-2,34(38)42)18-24-20-44-27-11-7-5-9-25(27)37(39(23,44)47-40(24,38)43)13-15-41(33(35)37)21-29-31(35)45-29/h5-12,23-24,29-34H,3-4,13-22H2,1-2H3/t23?,24?,29-,30-,31-,32-,33+,34+,35-,36-,37?,38?,39?,40?/m1/s1
- InChI Key： UMIVYNNQXZYFTJ-VFPMXPHMSA-N
- SMILES： O1C23C4CN5C6C=CC=CC=6C67CCN8C[C@@H]9[C@H]([C@@](CC)(CC(CN2C2C=CC=CC=2C23CCN3C[C@@H]%10[C@H]([C@@](CC)(C4)[C@H]32)O%10)C156)[C@H]87)O9
Computed Properties
- Exact Mass: 630.35728
- Monoisotopic Mass: 630.357
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 47
- Rotatable Bond Count: 2
- Complexity: 1370
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 10
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.2
- Topological Polar Surface Area: 47.2?2
Experimental Properties
- Density: 1.47
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.767
- PSA: 47.25
22a,23b-Epoxy-2H,11H,14H,22aH,23H,23bH-bisoxireno[6,7]indolizino[1,8-fg:1',8'-f'g'][1,5]diazocino[3,2,1-jk:7,6,5-j'k']dicarbazole,12a,24a-diethyl-1a,3a,4,5,11a,12,12a,12b,13a,15a,16,17,23a,24,24a,24b-hexadecahydro-,(1aR,3aS,5aR,11aS,12aS,12bS,13aR,15aS,17aR,22aR,23aS,23bR,24aS,24bS)- (9CI) Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
103590-56-3 (22a,23b-Epoxy-2H,11H,14H,22aH,23H,23bH-bisoxireno[6,7]indolizino[1,8-fg:1',8'-f'g'][1,5]diazocino[3,2,1-jk:7,6,5-j'k']dicarbazole,12a,24a-diethyl-1a,3a,4,5,11a,12,12a,12b,13a,15a,16,17,23a,24,24a,24b-hexadecahydro-,(1aR,3aS,5aR,11aS,12aS,12bS,13aR,15aS,17aR,22aR,23aS,23bR,24aS,24bS)- (9CI)) Related Products
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