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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H18N4O8
Molecular Weight 358.304
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ASPACYTARABINE

SMILES

N[C@@H](CC(=O)NC1=NC(=O)N(C=C1)[C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)C(O)=O

InChI

InChIKey=PVPJTBAEAQVTPN-HRAQMCAYSA-N
InChI=1S/C13H18N4O8/c14-5(12(22)23)3-8(19)15-7-1-2-17(13(24)16-7)11-10(21)9(20)6(4-18)25-11/h1-2,5-6,9-11,18,20-21H,3-4,14H2,(H,22,23)(H,15,16,19,24)/t5-,6+,9+,10-,11+/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H18N4O8
Molecular Weight 358.304
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
JL7V54Z2BR
Record Status Validated (UNII)
Record Version