correlation spectroscopy (COSY)
URL: https://www.chemotion-repository.net/inchikey/DMZUOABUOWFVOT-UHFFFAOYSA-N/CHMO0000599
Dataset description:
dataset for correlation spectroscopy (COSY)\n\n
Source: correlation spectroscopy (COSY)
Chemical Info
| InChI | InChI=1S/C106H80N10/c1-61-51-74(64-54-88-102(108-60-64)112-100-72-50-46-68(116-95-41-25-17-33-85(95)106(9,10)86-34-18-26-42-96(86)116)58-78(72)76-56-66(44-48-70(76)98(100)110-88)114-91-37-21-13-29-81(91)104(5,6)82-30-14-22-38-92(82)114)62(2)52-73(61)63-53-87-101(107-59-63)111-99-71-49-45-67(115-93-39-23-15-31-83(93)105(7,8)84-32-16-24-40-94(84)115)57-77(71)75-55-65(43-47-69(75)97(99)109-87)113-89-35-19-11-27-79(89)103(3,4)80-28-12-20-36-90(80)113/h11-60H,1-10H3 |
|---|---|
| SMILES | Cc1cc(c(cc1c1cnc2c(c1)nc1c(n2)c2ccc(cc2c2c1ccc(c2)N1c2ccccc2C(c2c1cccc2)(C)C)N1c2ccccc2C(c2c1cccc2)(C)C)C)c1cnc2c(c1)nc1c(n2)c2ccc(cc2c2c1ccc(c2)N1c2ccccc2C(c2c1cccc2)(C)C)N1c2ccccc2C(c2c1cccc2)(C)C |
| InChI Key | DMZUOABUOWFVOT-UHFFFAOYSA-N |
| Molecular Formula | C106H80N10 |
| Exact Mass | 1493.836 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 29, 2025 |
| Metadata last updated | January 29, 2025 |
| Created | January 29, 2025 |
| Format | HTML |
| License | No License Provided |
| Id | 52acaf11-151f-41f5-9c3d-79e0bbfd4a58 |
| Package id | 10-14272-dmzuoabuowfvot-uhfffaoysa-n-chmo0000599 |
| Resource type | HTML |
| State | active |