U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C61H88Cl2O33
Molecular Weight 1420.238
Optical Activity UNSPECIFIED
Defined Stereocenters 32 / 32
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Flambamycin

SMILES

COC[C@H]1O[C@@H](O[C@@H]2OC[C@@H]3O[C@]4(O[C@H]3[C@H]2OC(=O)C(C)C)O[C@H](C)[C@](O)([C@@H]5OCO[C@@H]45)C(C)=O)[C@@H](OC)[C@@H](O)[C@@H]1O[C@@H]6O[C@H](C)[C@H](OC)[C@H](O[C@@H]7O[C@H](C)[C@H]8O[C@]9(C[C@@H](O)[C@H](O[C@H]%10C[C@@H](O)[C@H](OC(=O)C%11=C(C)C(Cl)=C(O)C(Cl)=C%11OC)[C@@H](C)O%10)[C@@H](C)O9)O[C@]8(C)[C@@H]7O)[C@H]6O

InChI

InChIKey=IHGNORNGVOUHBM-TXXNROQVSA-N
InChI=1S/C61H88Cl2O33/c1-20(2)52(71)87-47-43-31(93-61(94-43)51-50(79-19-80-51)60(73,26(8)64)27(9)92-61)18-78-55(47)90-56-46(77-14)37(68)42(30(84-56)17-74-11)88-54-38(69)45(41(75-12)23(5)82-54)89-57-48(70)58(10)49(25(7)83-57)95-59(96-58)16-29(66)40(24(6)91-59)85-32-15-28(65)39(22(4)81-32)86-53(72)33-21(3)34(62)36(67)35(63)44(33)76-13/h20,22-25,27-32,37-43,45-51,54-57,65-70,73H,15-19H2,1-14H3/t22-,23-,24-,25-,27-,28-,29-,30-,31+,32+,37+,38-,39-,40-,41+,42-,43-,45-,46+,47-,48-,49-,50-,51-,54+,55+,56+,57+,58-,59-,60+,61-/m1/s1

HIDE SMILES / InChI

Molecular Formula C61H88Cl2O33
Molecular Weight 1420.238
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 32 / 32
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:16:26 GMT 2025
Edited
by admin
on Wed Apr 02 19:16:26 GMT 2025
Record UNII
2N45QSF4CB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RP-21190
Preferred Name English
Flambamycin
Common Name English
Antibiotic RP21190
Common Name English
O-(1R)-4-C-Acetyl-6-deoxy-2,3-O-methylene-D-galactopyranosylidene-(1?3-4)-2-O-(2-methyl-1-oxopropyl)-?-L-lyxopyranosyl O-2,6-dideoxy-4-O-(3,5-dichloro-4-hydroxy-2-methoxy-6-methylbenzoyl)-?-D-arabino-hexopyranosyl-(1?4)-O-(1R)-2,6-dideoxy-D-arabino-hexop
Systematic Name English
?-D-Mannopyranoside, O-(1R)-4-C-acetyl-6-deoxy-2,3-O-methylene-D-galactopyranosylidene-(1?3-4)-2-O-(2-methyl-1-oxopropyl)-?-L-lyxopyranosyl O-2,6-dideoxy-4-O-(3,5-dichloro-4-hydroxy-2-methoxy-6-methylbenzoyl)-?-D-arabino-hexopyranosyl-(1?4)-O-(1R)-2,6-di
Systematic Name English
Antibiotic RP-21190
Common Name English
RP21190
Code English
O-(1R)-4-C-Acetyl-6-deoxy-2,3-O-methylene-D-galactopyranosylidene-(1?3-4)-2-O-(2-methyl-1-oxopropyl)-?-L-lyxopyranosyl O-2,6-dideoxy-4-O-(3,5-dichloro-4-hydroxy-2-methoxy-6-methylbenzoyl)-?-D-arabino-hexopyranosyl-(1?4)-O-2,6-dideoxy-D-arabino-hexopyrano
Systematic Name English
Code System Code Type Description
CAS
42617-24-3
Created by admin on Wed Apr 02 19:16:26 GMT 2025 , Edited by admin on Wed Apr 02 19:16:26 GMT 2025
PRIMARY
PUBCHEM
168012418
Created by admin on Wed Apr 02 19:16:26 GMT 2025 , Edited by admin on Wed Apr 02 19:16:26 GMT 2025
PRIMARY
FDA UNII
2N45QSF4CB
Created by admin on Wed Apr 02 19:16:26 GMT 2025 , Edited by admin on Wed Apr 02 19:16:26 GMT 2025
PRIMARY