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Substance Name: Phorbol-12,13-dipropionate
RN: 51821-33-1
InChIKey: LMLOFRDITXUVHZ-BPNNYVJBSA-N

Note

  • Inhibitor of tumor promotion by TPA.

Molecular Formula

  • C26-H36-O8

Molecular Weight

  • 476.5624
 
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Names and Synonyms

Name of Substance

  • Phorbol-12,13-dipropionate

Synonym

  • Phorbol-12,13-didecanoate

Systematic Name

  • 5H-Cyclopropa(3,4)benz(1,2-e)azulen-5-one, 1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-9,9a-bis(1-oxopropoxy)-, (1aR-(1aalpha,1bbeta,4abeta,7aalpha,7balpha,8alpha,9beta,9aalpha))-

Registry Numbers

CAS Registry Number

  • 51821-33-1

System Generated Number

  • 0051821331

Structure Descriptors

InChI

1S/C26H36O8/c1-7-18(28)33-22-14(4)25(32)16(20-23(5,6)26(20,22)34-19(29)8-2)10-15(12-27)11-24(31)17(25)9-13(3)21(24)30/h9-10,14,16-17,20,22,27,31-32H,7-8,11-12H2,1-6H3/t14-,16+,17-,20-,22-,24-,25-,26-/m1/s1

InChIKey

LMLOFRDITXUVHZ-BPNNYVJBSA-N

Smiles

CCC(=O)O[C@@H]1[C@@H](C)[C@@]2(O)[C@@H](C=C(CO)C[C@@]3(O)[C@H]2C=C(C)C3=O)[C@@H]4C(C)(C)[C@]14OC(=O)CC