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Details

Stereochemistry EPIMERIC
Molecular Formula C53H83NO14
Molecular Weight 958.2244
Optical Activity UNSPECIFIED
Defined Stereocenters 14 / 15
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of EVEROLIMUS ISOMER C

SMILES

CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)C(=O)C(O)(O3)C(=O)N4CCCC[C@H]4C(=O)O2)OC)CC[C@H]1OCCO

InChI

InChIKey=USDOYNAPNXMXOE-YWBHOXRLSA-N
InChI=1S/C53H83NO14/c1-32-16-12-11-13-17-33(2)44(63-8)30-40-21-19-34(3)50(59)53(62,68-40)52(61)54-23-15-14-18-41(54)51(60)67-45(36(5)28-39-20-22-43(66-25-24-55)46(29-39)64-9)31-42(56)35(4)27-38(7)48(58)49(65-10)47(57)37(6)26-32/h11-13,16-17,27,32,34-37,39-41,43-46,48-49,55,58,62H,14-15,18-26,28-31H2,1-10H3/b13-11+,16-12+,33-17+,38-27+/t32-,34-,35-,36-,37-,39+,40+,41+,43-,44+,45+,46-,48-,49+,53?/m1/s1

HIDE SMILES / InChI

Molecular Formula C53H83NO14
Molecular Weight 958.2244
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 14 / 15
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 16:26:43 GMT 2025
Edited
by admin
on Tue Apr 01 16:26:43 GMT 2025
Record UNII
DP7PN8Y6FC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EVEROLIMUS ISOMER C
Common Name English
RAPAMYCIN, 9,14-DEEPOXY-15-DEOXO-14-DEOXY-9,15-EPOXY-15-HYDROXY-42-O-(2-HYDROXYETHYL)-14-OXO-
Preferred Name English
Code System Code Type Description
FDA UNII
DP7PN8Y6FC
Created by admin on Tue Apr 01 16:26:43 GMT 2025 , Edited by admin on Tue Apr 01 16:26:43 GMT 2025
PRIMARY
CAS
908340-97-6
Created by admin on Tue Apr 01 16:26:43 GMT 2025 , Edited by admin on Tue Apr 01 16:26:43 GMT 2025
PRIMARY
PUBCHEM
11722132
Created by admin on Tue Apr 01 16:26:43 GMT 2025 , Edited by admin on Tue Apr 01 16:26:43 GMT 2025
PRIMARY