Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Antibiotic C 076A2a
RN: 65195-54-2
InChIKey: QUTFLJHOCPQPEW-UQMQHJPWSA-N

Molecular Formula

  • C48-H74-O15

Molecular Weight

  • 891.0976
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • Antibiotic C 076A2a

Synonym

  • Antibiotic C 076A(sub 2a)

Systematic Name

  • Avermectin A1a, 25-de(1-methylpropyl)-22,23-dihydro-23-hydroxy-25-(1-methylethyl)-, (23S)-

Registry Numbers

CAS Registry Number

  • 65195-54-2

System Generated Number

  • 0065195542

Structure Descriptors

InChI

1S/C48H74O15/c1-24(2)41-28(6)35(49)22-47(63-41)21-33-18-32(62-47)16-15-26(4)42(60-39-20-37(54-10)44(30(8)58-39)61-38-19-36(53-9)40(50)29(7)57-38)25(3)13-12-14-31-23-56-45-43(55-11)27(5)17-34(46(51)59-33)48(31,45)52/h12-15,17,24-25,28-30,32-45,49-50,52H,16,18-23H2,1-11H3/b13-12+,26-15-,31-14+/t25?,28?,29-,30-,32?,33?,34?,35?,36-,37-,38-,39-,40-,41?,42?,43?,44-,45?,47?,48?/m0/s1

InChIKey

QUTFLJHOCPQPEW-UQMQHJPWSA-N

Smiles

C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@H]2[C@@H](O[C@H](C[C@@H]2OC)OC/3C(/C=C/C=C/4\COC5C4(C(C=C(C5OC)C)C(=O)OC6CC(C/C=C3/C)OC7(C6)CC(C(C(O7)C(C)C)C)O)O)C)C)OC)O