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Substance Name: Netzahualcoyonol
RN: 113579-07-0
InChIKey: AKILTDMBUDIAST-NQEVMONISA-N

Molecular Formula

  • C30-H38-O5

Molecular Weight

  • 478.6252
 
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Names and Synonyms

Results Name

  • Netzahualcoyonol

Synonym

  • Netzahualcoyonol

Systematic Name

  • D:A-Friedo-24,26-dinoroleana-1(10),3,5,7,14-pentaen-29-oic acid, 3,21-dihydroxy-15-methyl-2-oxo-, methyl ester, (20alpha,21beta)-

Registry Numbers

CAS Registry Number

  • 113579-07-0

System Generated Number

  • 0113579070

Structure Descriptors

InChI

1S/C30H38O5/c1-16-13-27(3)15-23(32)30(6,26(34)35-7)14-22(27)29(5)11-10-28(4)19(24(16)29)9-8-18-17(2)25(33)21(31)12-20(18)28/h8-9,12,22-23,32-33H,10-11,13-15H2,1-7H3/t22-,23-,27-,28+,29-,30-/m0/s1

InChIKey

AKILTDMBUDIAST-NQEVMONISA-N

Smiles

C1(C(=C(C2=CC=C3[C@@](CC[C@@]4(C3=C(C[C@@]3([C@@H]4C[C@@]([C@@H](C3)O)(C)C(OC)=O)C)C)C)(C)C2=C1)C)O)=O