dTDP-GlcNAcZ
- CAS No.: 1222982-68-4
- Molecular Weight：646.396
- Modify Date.: 2022-07-23 10:29
1. Names and Identifiers
- 1.1 Name
- dTDP-GlcNAcZ
- 1.2 CAS No.
- 1222982-68-4
- 1.3 Molecular Formula
- C18H28N6O16P2 (isomer)
- 1.4 Inchi
- InChI=1/C18H28N6O16P2/c1-7-4-24(18(31)22-16(7)30)12-2-8(26)10(37-12)6-36-41(32,33)40-42(34,35)39-17-13(21-11(27)3-20-23-19)15(29)14(28)9(5-25)38-17/h4,8-10,12-15,17,25-26,28-29H,2-3,5-6H2,1H3,(H,21,27)(H,32,33)(H,34,35)(H,22,30,31)/t8-,9+,10+,12+,13+,14+,15+,17+/s2
- 1.5 InChIkey
- KNCUZEULMYBAPE-ZLNPIVJENA-N
- 1.6 Canonical Smiles
- CC1=CN([C@H]2C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(=O)CN=N#N)O2)C(=O)NC1=O
- 1.7 Isomers Smiles
- CC1=CN([C@H]2C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(=O)CN=N#N)O2)C(=O)NC1=O
2. Properties
- 2.1 PSA
- 355.00000
- 2.1 logP
- -3.17824
4. Realated Product Infomation
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