KEGG   COMPOUND: C13112
Entry
C13112                      Compound                               
Name
Ancitabin hydrochloride;
Cyclocytidine
Formula
C9H11N3O4. HCl
Exact mass
261.0516
Mol weight
261.6623
Structure
Remark
Same as: D01651
Brite
Drug groups [BR:br08330]
 Antineoplastic
  DG02018  Antimetabolite
   DG01958  Nucleic acid derivative, antineoplastic
    DG01439  Arabinofuranosyl type antineoplastic
     D01651  Ancitabine hydrochloride
Other DBs
CAS: 10212-25-6
PubChem: 585176
ChEBI: 74843
NIKKAJI: J268.819K
LinkDB
KCF data

ATOM        17
            1   X   Cl   25.2357  -19.9363
            2   O2x O    19.6746  -15.3163
            3   C1y C    18.5383  -16.1428
            4   C1y C    18.9741  -17.4743
            5   C1y C    20.8111  -16.1428
            6   C1y C    20.3780  -17.4757
            7   O2x O    21.5118  -18.2997
            8   N4y N    22.2126  -16.1428
            9   C8y C    22.6382  -17.4763
            10  N5x N    24.0059  -17.7744
            11  C8y C    24.9480  -16.7391
            12  C8x C    24.5223  -15.4057
            13  C8x C    23.2481  -15.1075
            14  C1b C    17.2054  -15.7117
            15  O1a O    16.1656  -16.6504
            16  O1a O    18.1513  -18.6081
            17  N2a N    26.3166  -17.0374
BOND        18
            1     4   6 1
            2     5   2 1
            3     8   9 1
            4     9  10 2
            5    10  11 1
            6    11  12 1
            7    12  13 2
            8    13   8 1
            9     5   6 1
            10    3  14 1 #Up
            11    6   7 1
            12   14  15 1
            13    7   9 1
            14    4  16 1 #Down
            15    5   8 1
            16   11  17 2
            17    2   3 1
            18    3   4 1

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