Basic information
- CAS
83379-28-6- Standard SMILES
NC(=O)c1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c2ncnc(N)c12- InChIKey
SSAXPGYDNCGRHY-XLPZGREQSA-N- Molecular formula
- C12H15N5O4
- Average molar mass
- 293.28 g/mol
- Monoisotopic mass
- 293.11240398
Names & identifiers
- Preferred name
- 2'-Deoxysangivamycin
- IUPAC
- 4-amino-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide
- English name
- 2'-deoxysangivamycin
- Molecular formula
- C12H15N5O4
- Molecular weight
- 293.28
Names & synonyms
2'-Deoxysangivamycin83379-28-6DTXSID202323067H-Pyrrolo(2,3-d)pyrimidine-5-carboxamide, 4-amino-7-(2-deoxy-beta-D-erythro-pentofuranosyl)-4-amino-7-(2-deoxy-beta-D-ribofuranosyl)pyrrolo(2,3-d)pyrimidine-5-carboxamideRefChem:80309DTXCID801547974-Amino-7-(2-deoxy-b-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-5-carboxamide4-amino-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide4-Amino-7-(2-deoxy-beta-D-erythro-pentofuranosyl)-7H-pyrrolo(2,3-d)pyrimidine-5-carboxamide2'-Deoxy-sangivamycinNSC 295391
Show more names
4-Amino-7-(2-deoxy--D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-5-carboxamide4-Amino-7-(2-deoxy-β-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-5-carboxamide7-(2-Deoxy-β-D-ribofuranosyl)-4-amino-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide7H-Pyrrolo[2,3-d]pyrimidine-5-carboxamide, 4-amino-7-(2-deoxy-β-D-erythro-pentofuranosyl)-4-amino-7-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide
BRN 5111664NSC2953914-Amino-7-(2-deoxy-beta-D-erythro-pentofuranosyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamideCHEMBL3142730SCHEMBL237459284-Amino-7-(4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid amideNA1446854-amino-7-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 411
Physicochemical properties
- Boiling point
- 763.7 · 763.7±60.0 °C(Predicted)
- Density
- 1.92 · 1.92±0.1 g/cm3(Predicted)
- pka
- 13.3 · 13.30±0.60(Predicted)
Chemistry & industry
Suppliers4 total
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
杭州六可生物科技有限公司+86-571-86912261 19975279805 · [email protected]
BOC Sciences16314854226 · [email protected]
浙江天酶生物工程有限公司19967302939 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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