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Substance Name: 21,23-Diacetyl-27,28-didehydro-12-dehydroxy-27-demethoxy-12,19-dideoxy-11,28,29-trihydro-29-oxorifamycin s
RN: 172097-90-4
InChIKey: VFHVFZGEHDYFSN-FHEAGCJCSA-N

Molecular Formula

  • C40-H47-N-O12

Molecular Weight

  • 733.8063
 
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Names and Synonyms

  • 21,23-Diacetyl-27,28-didehydro-12-dehydroxy-27-demethoxy-12,19-dideoxy-11,28,29-trihydro-29-oxorifamycin s

Registry Numbers

CAS Registry Number

  • 172097-90-4

System Generated Number

  • 0172097904

Structure Descriptors

InChI

1S/C40H47NO12/c1-19(36(51-26(8)43)24(6)38(53-28(10)45)25(7)37(52-27(9)44)20(2)15-12-16-42)13-11-14-21(3)40(49)41-30-18-31(46)32-29-17-22(4)50-39(29)23(5)34(47)33(32)35(30)48/h11-20,24-25,36-38,47H,1-10H3,(H,41,49)/b13-11+,15-12+,21-14-/t19-,20+,24+,25-,36-,37+,38+/m0/s1

InChIKey

VFHVFZGEHDYFSN-FHEAGCJCSA-N

Smiles

C[C@H](\C=C\C=O)[C@@H](OC(=O)C)[C@H](C)[C@H](OC(=O)C)[C@H](C)[C@@H](OC(=O)C)[C@@H](C)\C=C\C=C(\C)/C(=O)NC1=CC(=O)c2c(C1=O)c(O)c(C)c3oc(C)cc23