ERYTHROMYCIN ACISTRATE

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 6383U5A1KE

Structure
InChI Key CVBHEIRZLPKMSH-SNWVVRALSA-N
Smile CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2OC(C)=O)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O
InChI
InChI=1S/C39H69NO14/c1-15-27-39(11,47)32(43)21(4)29(42)19(2)17-37(9,46)34(54-36-31(51-25(8)41)26(40(12)13)16-20(3)49-36)22(5)30(23(6)35(45)52-27)53-28-18-38(10,48-14)33(44)24(7)50-28/h19-24,26-28,30-34,36,43-44,46-47H,15-18H2,1-14H3/t19-,20-,21+,22+,23-,24+,26+,27-,28+,30+,31-,32-,33+,34-,36+,37-,38-,39-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C39H69NO14
Molecular Weight 775.97
AlogP 2.36
Hydrogen Bond Acceptor 15.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 8.0
Polar Surface Area 199.98
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 54.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 135882
ChEMBL CHEMBL2110577
DrugCentral 1049
FDA SRS 6383U5A1KE
PubChem 5284554
ZINC ZINC000085540310
CONTENTS