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Substance Name: Verrucarin A, 7'-deoxo-7'-((1S)-1-hydroxyethyl)-, (7'R)-
RN: 84773-08-0
InChIKey: NSFWWJIQIKBZMJ-AJCAISIOSA-N

Molecular Weight

  • 532.626
 
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Names and Synonyms

  • Verrucarin A, 7'-deoxo-7'-((1S)-1-hydroxyethyl)-, (7'R)-

Registry Numbers

CAS Registry Number

  • 84773-08-0

System Generated Number

  • 0084773080

Structure Descriptors

InChI

1S/C29H40O9/c1-17-9-11-28-15-35-26(33)25(32)18(2)10-12-34-20(19(3)30)7-5-6-8-24(31)38-21-14-23(37-22(28)13-17)29(16-36-29)27(21,28)4/h5-8,13,18-23,25,30,32H,9-12,14-16H2,1-4H3/b7-5+,8-6+/t18-,19+,20-,21-,22-,23-,25+,27-,28-,29+/m1/s1

InChIKey

NSFWWJIQIKBZMJ-AJCAISIOSA-N

Smiles

C1OC([C@H]([C@@H](CCO[C@H](C=CC=CC(O[C@H]2[C@@]3([C@]41[C@H](O[C@H]([C@@]13OC1)C2)C=C(C)CC4)C)=O)[C@H](C)O)C)O)=O