4-(N-[2,4-DIAMINO-6-PTERIDINYLMETHYL]-AMINO)BENZOIC ACID SODIUM SALT

CAS No.
100929-45-1 ;36093-85-3
CCD No.
CCD00006426
Formula
C14 H12 N7 O2 . Na
MolWeight
333.286

Basic Information

Product Name: 4-(N-[2,4-DIAMINO-6-PTERIDINYLMETHYL]-AMINO)BENZOIC ACID SODIUM SALT
CAS: 100929-45-1 ;36093-85-3
English Synonyms: 4-AMINO-4-DEOXYPTEROIC ACID SODIUM SALT ; 4-(N-[2,4-DIAMINO-6-PTERIDINYLMETHYL]-AMINO)BENZOIC ACID SODIUM SALT ; 4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)AMINO]BENZOIC ACID SODIUM
MDL Number.: MFCD00006709
H bond acceptor: 9
H bond donor: 3
Smile: c1cc(ccc1C(=O)[O-])NCc2cnc3c(n2)c(nc(n3)N)N.[Na+]
InChi: InChI=1S/C14H13N7O2.Na/c15-11-10-12(21-14(16)20-11)18-6-9(19-10)5-17-8-3-1-7(2-4-8)13(22)23;/h1-4,6,17H,5H2,(H,22,23)(H4,15,16,18,20,21);/q;+1/p-1
InChiKey: InChIKey=NDXULQWYAMJQGC-UHFFFAOYSA-M

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