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Substance Name: 30-Noroleana-12,18-dien-29-oic acid, 3-hydroxy-, ethyl ester, (3beta,20beta)-
RN: 116965-75-4
InChIKey: MTXHDAPYSWMIFV-GJPGAMCVSA-N

Molecular Formula

  • C31-H48-O3

Molecular Weight

  • 468.7172
 
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Names and Synonyms

  • 30-Noroleana-12,18-dien-29-oic acid, 3-hydroxy-, ethyl ester, (3beta,20beta)-

Registry Numbers

CAS Registry Number

  • 116965-75-4

System Generated Number

  • 0116965754

Structure Descriptors

InChI

1S/C31H48O3/c1-8-34-26(33)20-11-14-28(4)17-18-30(6)21(22(28)19-20)9-10-24-29(5)15-13-25(32)27(2,3)23(29)12-16-31(24,30)7/h9,19-20,23-25,32H,8,10-18H2,1-7H3/t20-,23-,24?,25-,28+,29-,30+,31+/m0/s1

InChIKey

MTXHDAPYSWMIFV-GJPGAMCVSA-N

Smiles

C1=C2C=3[C@@](CC[C@@]2(C)CC[C@@H]1C(OCC)=O)([C@@]1([C@@H]([C@@]2([C@@H](CC1)C([C@@H](CC2)O)(C)C)C)CC3)C)C