KEGG   DRUG: Thiotepa
Entry
D00583                      Drug                                   

Name
Thiotepa (JAN/USP/INN);
Thioplex (TN);
Tepadina (TN);
Rethio (TN)
Product
  Generic
Formula
C6H12N3PS
Exact mass
189.049
Mol weight
189.2183
Structure
Simcomp
Class
Antineoplastic
 DG01677  Alkylating agent
  DG01723  Ethylene imine
   DG01722  Thiotepa type ethylene imine
Remark
Same as: C07641
Therapeutic category: 4212
ATC code: L01AC01
Product: D00583<JP/US>
Efficacy
Antineoplastic, Alkylating agent
  Disease
Beta-Thalassemia [DS:H00228]
Graft rejection [DS:H00083]
Adenocarcinoma of the breast or ovary [DS:H00031 H00027]
Papillary carcinoma of the urinary bladder [DS:H00022]
Comment
Ethylene imine
Target
DNA
Interaction
Structure map
map07040  Antineoplastics - alkylating agents
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01A ALKYLATING AGENTS
    L01AC Ethylene imines
     L01AC01 Thiotepa
      D00583  Thiotepa (JAN/USP/INN) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  42  Antineoplastics
   421  Alkylating agents
    4212  Ethyleneimines
     D00583  Thiotepa (JAN/USP/INN)
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D00583
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D00583
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D00583
Other DBs
CAS: 52-24-4
PubChem: 7847649
ChEBI: 9570
ChEMBL: CHEMBL671
DrugBank: DB04572
LigandBox: D00583
NIKKAJI: J2.307H
LinkDB
KCF data

ATOM        11
            1   P1a P    24.9258  -18.5335
            2   N1y N    26.3230  -18.5335
            3   N1y N    23.5287  -18.5277
            4   N1y N    24.9200  -17.1364
            5   S0  S    24.9200  -19.9365
            6   C1x C    27.5332  -19.2350
            7   C1x C    27.5272  -17.8320
            8   C1x C    22.3128  -17.8262
            9   C1x C    22.3185  -19.2350
            10  C1x C    25.6098  -15.9203
            11  C1x C    24.2068  -15.8680
BOND        13
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 2
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 1
            10    4  11 1
            11    6   7 1
            12    8   9 1
            13   10  11 1

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