Discuss This Drug

tacrolimus hydrate

CHEBI:CHEBI_61057

Definition

A hydrate that is the monohydrate form of tacrolimus.

Chemical Information

Molecular Formula
C44H71NO13
Molecular Mass
822.03340
Charge
0
SMILES
O.CO[C@@H]1C[C@@H](CC[C@H]1O)\C=C(/C)[C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@H]([C@H](C[C@@H](C)C\C(C)=C\[C@@H](CC=C)C(=O)C[C@H](O)[C@H]1C)OC)[C@H](C[C@H]2C)OC
InChI
InChI=1S/C44H69NO12.H2O/c1-10-13-31-19-25(2)18-26(3)20-37(54-8)40-38(55-9)22-28(5)44(52,57-40)41(49)42(50)45-17-12-11-14-32(45)43(51)56-39(29(6)34(47)24-35(31)48)27(4)21-30-15-16-33(46)36(23-30)53-7;/h10,19,21,26,28-34,36-40,46-47,52H,1,11-18,20,22-24H2,2-9H3;1H2/b25-19+,27-21+;/t26-,28+,29+,30-,31+,32-,33+,34-,36+,37-,38-,39+,40+,44+;/m0./s1
InChIKey
NWJQLQGQZSIBAF-MLAUYUEBSA-N

Alternative Names

  • Prograf
  • tacrolimus
  • Protopic
  • tacrolimus monohydrate
  • tsukubaenolide hydrate
  • (-)-(3S,4R,5S,8R,9E,12S,14S,15R,16S,18R,19R,26aS)-5,19-dihydroxy-3-{(1E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl}-14,16-dimethoxy-4,10,12,18-tetramethyl-8-(prop-2-en-1-yl)-5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-3H-15,19-epoxypyrido[2,1-c][1,4]oxazacyclotricosine-1,7,20,21(4H,23H)-tetrone monohydrate
  • (3S,4R,5S,8R,9E,12S,14S,15R,16S,18R,19R,26aS)-5,19-dihydroxy-3-{(1E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl}-14,16-dimethoxy-4,10,12,18-tetramethyl-8-(prop-2-en-1-yl)-5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-3H-15,19-epoxypyrido[2,1-c][1,4]oxazacyclotricosine-1,7,20,21(4H,23H)-tetrone--water (1/1)

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

DRON_00010000
42316
oboInOwl#hasDbXref
Reaxys:6265275
core#notation
CHEBI:61057

Additional References

🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.

Additional Attributes

package_ndc
65050-0321-5
product_type
BULK INGREDIENT
marketing_category
BULK INGREDIENT FOR HUMAN PRESCRIPTION COMPOUNDING
dosage_form
GRANULE, FOR SUSPENSION
labeler_name
BionPharma Inc.,
application_number
NDA050708
product_ndc
82804-032
route
TOPICAL
spl_id
0d6bf85c-3bbc-4b8d-e063-6294a90a728e
oboInOwl#hasOBONamespace
chebi_ontology
DRON_00010000
42316
oboInOwl#hasDbXref
Reaxys:6265275
brand_name
Envarsus XR
brand_name_base
Envarsus
generic_name
Tacrolimus Monohydrate
oboInOwl#id
CHEBI:61057
RO_0000087
http://purl.obolibrary.org/obo/CHEBI_35705
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
BFO_0000051
http://purl.obolibrary.org/obo/CHEBI_61049
package_description
500 g in 1 BAG (65050-0321-5)
rxcui
314266
active_ingredient_strength
.3 mg/g
active_ingredient_name
TACROLIMUS
unii
WM0HAQ4WNM
spl_set_id
17e25eb5-8d63-48aa-48f1-26342340b791
upc
0369452155202
package_marketing_start_date
28-NOV-12
core#notation
CHEBI:61057
pharm_class
Calcineurin Inhibitors [MoA]
brand_name_suffix
XR
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
manufacturer_name
BionPharma Inc.,
listing_expiration_date
20241231
marketing_start_date
19940408
has_treatment
http://purl.obolibrary.org/obo/DOID_0070528
owl#annotatedSource
t259495
owl#someValuesFrom
t3309263