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Substance Name: Acacic Acid
RN: 1962-14-7
UNII: Q40GL8U88D
InChIKey: CFKXWTNHIJAFNL-OOURDANISA-N

Molecular Formula

  • C30-H48-O5

Molecular Weight

  • 488.7042
 
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Names and Synonyms

Name of Substance

  • Acacic acid

Synonyms

  • Acacic acid
  • UNII-Q40GL8U88D

Systematic Name

  • Olean-12-en-28-oic acid, 3,16,21-trihydroxy-, (3beta,16alpha,21beta)-

Registry Numbers

CAS Registry Number

  • 1962-14-7

FDA UNII

  • Q40GL8U88D

System Generated Number

  • 0001962147

Structure Descriptors

InChI

1S/C30H48O5/c1-25(2)14-18-17-8-9-20-27(5)12-11-21(31)26(3,4)19(27)10-13-28(20,6)29(17,7)15-23(33)30(18,24(34)35)16-22(25)32/h8,18-23,31-33H,9-16H2,1-7H3,(H,34,35)/t18-,19-,20+,21-,22-,23+,27-,28+,29+,30+/m0/s1

InChIKey

CFKXWTNHIJAFNL-OOURDANISA-N

Smiles

CC1(C)C[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)C[C@@H](O)[C@]2(C[C@@H]1O)C(=O)O