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Details

Stereochemistry EPIMERIC
Molecular Formula C36H50ClN3O10
Molecular Weight 720.249
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MAYTANBUTINE

SMILES

[H][C@@]12C[C@@](O)(NC(=O)O1)[C@H](OC)\C=C\C=C(C)\CC3=CC(N(C)C(=O)C[C@]([H])(OC(=O)C(C)N(C)C(=O)C(C)C)[C@]4(C)O[C@H]4[C@@H]2C)=C(Cl)C(OC)=C3

InChI

InChIKey=RJIVUFYDGYNSNE-BGOHZRNNSA-N
InChI=1S/C36H50ClN3O10/c1-19(2)32(42)39(7)22(5)33(43)49-28-17-29(41)40(8)24-15-23(16-25(46-9)30(24)37)14-20(3)12-11-13-27(47-10)36(45)18-26(48-34(44)38-36)21(4)31-35(28,6)50-31/h11-13,15-16,19,21-22,26-28,31,45H,14,17-18H2,1-10H3,(H,38,44)/b13-11+,20-12+/t21-,22?,26+,27-,28+,31+,35+,36+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
MAYTANBUTINE
Common Name English
MAYTANSINE, N2'-DEACETYL-N2'-(2-METHYL-1-OXOPROPYL)-
Systematic Name English
NSC-165014
Code English
Code System Code Type Description
PUBCHEM
6438456
Created by admin on Sat Dec 16 12:43:16 GMT 2023 , Edited by admin on Sat Dec 16 12:43:16 GMT 2023
PRIMARY
FDA UNII
UGX4BO6MOQ
Created by admin on Sat Dec 16 12:43:16 GMT 2023 , Edited by admin on Sat Dec 16 12:43:16 GMT 2023
PRIMARY
CAS
38997-10-3
Created by admin on Sat Dec 16 12:43:16 GMT 2023 , Edited by admin on Sat Dec 16 12:43:16 GMT 2023
PRIMARY
NSC
165014
Created by admin on Sat Dec 16 12:43:16 GMT 2023 , Edited by admin on Sat Dec 16 12:43:16 GMT 2023
PRIMARY